CHEMBL178 - Purchasable Bioactives

54 items from 41 vendors

vendor	vendor_id
001chem	DY10456
1pchembb	1P0037YT, 1P00I4G8
abovchem	HY-13062, HY-13062A
accela	SY058973
achemblock	H-8446
akscip-v	E380
aladdinsci	D122335, D409068
apexbt	AMY10310
apexmol	AMY10310
apichem	AC-6926
apollobio	BID0122
astatech	44040
astateche	41058
boerchembb	BC209620
bosche	D3454
cayman	14159
chebi	CHEBI:41977
chemyuhao	LT7755, XJ4606
dball	DB00694
dbap	DB00694
dbfda	DB00694
excenen	EX-A2649
fda	DB00694
hairui	HR127177, HR137580
hmdbdrug	HMDB0014832
keggcviapc	C01907
keggdviapc	D07776, D01264, D10787
keyobio	KS-5149
lincs	BRD-A37630846, BRD-K91966436, BRD-A68009927, BRD-K43389675
mce	HY-13062
mcep-v	HY-13062R
molcore	MC10456
molnova	M13676, M13246
pdb	DM1
selleck	S3035, S3035, S3035
struchembb	SC-18793
targetmolbio	T1511
targetmolnp	T1511
tetrahedronbb	TS83536
tocris	1467
urine	HMDB0014832

57 unique SMILES at similarity level 1

001chem (1)

vendor_id	similarity_code
DY620840	[0,0,0,0,0,0\|1,0,0]=1

001chem (1)

vendor_id	similarity_code
DY560715	[0,1,0,0,0,0\|0,0,0]=1

1pchembb (1)

vendor_id	similarity_code
1P01QTMH	[0,0,0,0,0,0\|1,0,0]=1

1pchembb (1)

vendor_id	similarity_code
1P00DCWQ	[1,0,0,0,0,0\|0,0,0]=1

1pchembb (1)

vendor_id	similarity_code
1P0036CO	[0,1,0,0,0,0\|0,0,0]=1

1pchembb (1)

vendor_id	similarity_code
1P0039K1	[0,1,0,0,0,0\|0,0,0]=1

1pchembb (1)

vendor_id	similarity_code
1P00382G	[0,1,0,0,0,0\|0,0,0]=1

abovchem (2)

vendor_id	similarity_code
HY-13624	[0,1,0,0,0,0\|0,0,0]=1
HY-13624A	[0,1,0,0,0,0\|0,0,0]=1

abovchem (2)

vendor_id	similarity_code
HY-15142	[0,1,0,0,0,0\|0,0,0]=1
HY-15142A	[0,1,0,0,0,0\|0,0,0]=1

abovchem (1)

vendor_id	similarity_code
AC510707	[0,1,0,0,0,0\|0,0,0]=1

dbfda (1)

vendor_id	similarity_code
DB00997	[0,1,0,0,0,0\|0,0,0]=1

fda (1)

vendor_id	similarity_code
DB00997	[0,1,0,0,0,0\|0,0,0]=1

hmdbdrug (1)

vendor_id	similarity_code
HMDB0015132	[0,1,0,0,0,0\|0,0,0]=1

accela (1)

vendor_id	similarity_code
SY059508	[0,1,0,0,0,0\|0,0,0]=1

dball (1)

vendor_id	similarity_code
DB00997	[0,1,0,0,0,0\|0,0,0]=1

dbap (1)

vendor_id	similarity_code
DB00997	[0,1,0,0,0,0\|0,0,0]=1

dbin (1)

vendor_id	similarity_code
DB00997	[0,1,0,0,0,0\|0,0,0]=1

urine (1)

vendor_id	similarity_code
HMDB0015132	[0,1,0,0,0,0\|0,0,0]=1

achemblock (1)

vendor_id	similarity_code
10488	[0,1,0,0,0,0\|0,0,0]=1

apollobio (1)

vendor_id	similarity_code
BIFK0018	[0,1,0,0,0,0\|0,0,0]=1

bosche (2)

vendor_id	similarity_code
E3453	[0,1,0,0,0,0\|0,0,0]=1
E3453	[0,1,0,0,0,0\|0,0,0]=1

chemyuhao (1)

vendor_id	similarity_code
LT6020	[0,1,0,0,0,0\|0,0,0]=1

molnova (1)

vendor_id	similarity_code
M15051	[0,1,0,0,0,0\|0,0,0]=1

achemblock (1)

vendor_id	similarity_code
H-8445	[0,1,0,0,0,0\|0,0,0]=1

apollobio (1)

vendor_id	similarity_code
BID0120	[0,1,0,0,0,0\|0,0,0]=1

ibsdrugs (1)

vendor_id	similarity_code
Bio-0029	[0,1,0,0,0,0\|0,0,0]=1

molnova (2)

vendor_id	similarity_code
M13659	[0,1,0,0,0,0\|0,0,0]=1
M13752	[0,1,0,0,0,0\|0,0,0]=1

aksci (1)

vendor_id	similarity_code
V1723	[1,0,0,0,0,0\|0,0,0]=1

aksci-v (1)

vendor_id	similarity_code
V1723	[1,0,0,0,0,0\|0,0,0]=1

keggcviapc (1)

vendor_id	similarity_code
C12432	[1,0,0,0,0,0\|0,0,0]=1

aladdinsci (4)

vendor_id	similarity_code
A183027	[0,1,0,0,0,0\|0,0,0]=1
D107159	[0,1,0,0,0,0\|0,0,0]=1
D396221	[0,1,0,0,0,0\|0,0,0]=1
E122334	[0,1,0,0,0,0\|0,0,0]=1

pipharm (1)

vendor_id	similarity_code
PI-21745	[0,1,0,0,0,0\|0,0,0]=1

selleck (8)

vendor_id	similarity_code
S1208	[0,1,0,0,0,0\|0,0,0]=1
S1208	[0,1,0,0,0,0\|0,0,0]=1
S1208	[0,1,0,0,0,0\|0,0,0]=1
S1208	[0,1,0,0,0,0\|0,0,0]=1
S1223	[0,1,0,0,0,0\|0,0,0]=1
S1223	[0,1,0,0,0,0\|0,0,0]=1
S1223	[0,1,0,0,0,0\|0,0,0]=1
S1223	[0,1,0,0,0,0\|0,0,0]=1

aladdinsci (2)

vendor_id	similarity_code
D409016	[0,1,0,0,0,0\|0,0,0]=1
E408486	[0,1,0,0,0,0\|0,0,0]=1

ambintnp (2)

vendor_id	similarity_code
Amb6600395	[0,1,0,0,0,0\|0,0,0]=1
Amb8496729	[0,1,0,0,0,0\|0,0,0]=1

molcore (1)

vendor_id	similarity_code
MC10454	[0,1,0,0,0,0\|0,0,0]=1

amc (1)

vendor_id	similarity_code
4072	[0,1,0,0,0,0\|0,0,0]=1

apexbt (1)

vendor_id	similarity_code
AMY10308	[0,1,0,0,0,0\|0,0,0]=1

apexmol (1)

vendor_id	similarity_code
AMY10308	[0,1,0,0,0,0\|0,0,0]=1

keggcviapc (1)

vendor_id	similarity_code
C11230	[0,1,0,0,0,0\|0,0,0]=1

keggdviapc (2)

vendor_id	similarity_code
D02214	[0,1,0,0,0,0\|0,0,0]=1
D07901	[0,1,0,0,0,0\|0,0,0]=1

apichem (1)

vendor_id	similarity_code
AC-387	[0,1,0,0,0,0\|0,0,0]=1

bosche (2)

vendor_id	similarity_code
D0108	[0,1,0,0,0,0\|0,0,0]=1
D0108	[0,1,0,0,0,0\|0,0,0]=1

chemyuhao (1)

vendor_id	similarity_code
LX2703	[0,1,0,0,0,0\|0,0,0]=1

astatech-v (1)

vendor_id	similarity_code
H11954	[0,1,0,0,0,0\|0,0,0]=1

astateche (1)

vendor_id	similarity_code
30760	[0,1,0,0,0,0\|0,0,0]=1

excenen (1)

vendor_id	similarity_code
EX-A1337	[0,1,0,0,0,0\|0,0,0]=1

indofine (1)

vendor_id	similarity_code
BIO-172	[0,1,0,0,0,0\|0,0,0]=1

astatech (1)

vendor_id	similarity_code
D83113	[0,1,0,0,0,0\|0,0,0]=1

astatech-v (1)

vendor_id	similarity_code
41054	[0,1,0,0,0,0\|0,0,0]=1

excenen (1)

vendor_id	similarity_code
EX-A2654	[0,1,0,0,0,0\|0,0,0]=1

indofine (1)

vendor_id	similarity_code
BIO-804	[0,1,0,0,0,0\|0,0,0]=1

astatechp-v (1)

vendor_id	similarity_code
C90624	[0,1,0,0,0,0\|0,0,0]=1

bioaustralis (1)

vendor_id	similarity_code
BIA-D2311	[0,0,0,0,0,0\|0,0,1]=1

bioaustralis (1)

vendor_id	similarity_code
BIA-D1229	[0,1,0,0,0,0\|0,0,0]=1

boerchembb (1)

vendor_id	similarity_code
BC200414	[0,1,0,0,0,0\|0,0,0]=1

boerchembb (1)

vendor_id	similarity_code
BC208841	[0,1,0,0,0,0\|0,0,0]=1

cayman (1)

vendor_id	similarity_code
12091	[0,1,0,0,0,0\|0,0,0]=1

chebi (1)

vendor_id	similarity_code
CHEBI:47898	[0,1,0,0,0,0\|0,0,0]=1

bosche (1)

vendor_id	similarity_code
D5560	[0,1,0,0,0,0\|0,0,0]=1

bosche (1)

vendor_id	similarity_code
E5582	[0,1,0,0,0,0\|0,0,0]=1

cayman (1)

vendor_id	similarity_code
15007	[0,1,0,0,0,0\|0,0,0]=1

chebi (1)

vendor_id	similarity_code
CHEBI:28748	[0,1,0,0,0,0\|0,0,0]=1

pdb (1)

vendor_id	similarity_code
DM2	[0,1,0,0,0,0\|0,0,0]=1

tetrahedronbb (1)

vendor_id	similarity_code
TS64858	[0,1,0,0,0,0\|0,0,0]=1

tocris (1)

vendor_id	similarity_code
2252	[0,1,0,0,0,0\|0,0,0]=1

chebi (1)

vendor_id	similarity_code
CHEBI:64677	[0,0,0,0,0,0\|0,0,1]=1

chebi (1)

vendor_id	similarity_code
CHEBI:31359	[1,0,0,0,0,0\|0,0,0]=1

chemodexe (1)

vendor_id	similarity_code
D0257	[0,1,0,0,0,0\|0,0,0]=1

chemyuhao (1)

vendor_id	similarity_code
RT6708	[1,0,0,0,0,0\|0,0,0]=1

molnova (1)

vendor_id	similarity_code
M14357	[1,0,0,0,0,0\|0,0,0]=1

chemyuhao (1)

vendor_id	similarity_code
RT19018	[0,1,0,0,0,0\|0,0,0]=1

chemyuhao (1)

vendor_id	similarity_code
LQ4401	[0,1,0,0,0,0\|0,0,0]=1

keyobio (1)

vendor_id	similarity_code
AS-31687	[0,1,0,0,0,0\|0,0,0]=1

mce (1)

vendor_id	similarity_code
HY-15142R	[0,1,0,0,0,0\|0,0,0]=1

mcep (1)

vendor_id	similarity_code
HY-15142	[0,1,0,0,0,0\|0,0,0]=1

dball (1)

vendor_id	similarity_code
DB00445	[0,1,0,0,0,0\|0,0,0]=1

dbap (1)

vendor_id	similarity_code
DB00445	[0,1,0,0,0,0\|0,0,0]=1

urine (1)

vendor_id	similarity_code
HMDB0014588	[0,1,0,0,0,0\|0,0,0]=1

dbfda (1)

vendor_id	similarity_code
DB00445	[0,1,0,0,0,0\|0,0,0]=1

fda (1)

vendor_id	similarity_code
DB00445	[0,1,0,0,0,0\|0,0,0]=1

hmdbdrug (1)

vendor_id	similarity_code
HMDB0014588	[0,1,0,0,0,0\|0,0,0]=1

excenen (1)

vendor_id	similarity_code
EX-A2244	[1,0,0,0,0,0\|0,0,0]=1

hairui (4)

vendor_id	similarity_code
ALSA02105	[0,1,0,0,0,0\|0,0,0]=1
HR122135	[0,1,0,0,0,0\|0,0,0]=1
HR133878	[0,1,0,0,0,0\|0,0,0]=1
ZOCQ02608	[0,1,0,0,0,0\|0,0,0]=1

keggcviapc (1)

vendor_id	similarity_code
C01661	[0,1,0,0,0,0\|0,0,0]=1

keggdviapc (2)

vendor_id	similarity_code
D01275	[0,1,0,0,0,0\|0,0,0]=1
D03899	[0,1,0,0,0,0\|0,0,0]=1

keggdviapc (1)

vendor_id	similarity_code
D03414	[1,0,0,0,0,0\|0,0,0]=1

mcep (1)

vendor_id	similarity_code
HY-B2171A	[1,0,0,0,0,0\|0,0,0]=1

mcep-v (1)

vendor_id	similarity_code
HY-B2171	[1,0,0,0,0,0\|0,0,0]=1

labseekerbb (3)

vendor_id	similarity_code
SC-12656	[0,1,0,0,0,0\|0,0,0]=1
SC-17005	[0,1,0,0,0,0\|0,0,0]=1
SC-18026	[0,1,0,0,0,0\|0,0,0]=1

struchembb (4)

vendor_id	similarity_code
SC-12656	[0,1,0,0,0,0\|0,0,0]=1
SC-17005	[0,1,0,0,0,0\|0,0,0]=1
SC-18025	[0,1,0,0,0,0\|0,0,0]=1
SC-18026	[0,1,0,0,0,0\|0,0,0]=1

lincs (1)

vendor_id	similarity_code
BRD-A76941896	[0,1,0,0,0,0\|0,0,0]=1

lincs (1)

vendor_id	similarity_code
BRD-A56518012	[0,1,0,0,0,0\|0,0,0]=1

lincs (1)

vendor_id	similarity_code
BRD-A52530684	[0,1,0,0,0,0\|0,0,0]=1

lincs (1)

vendor_id	similarity_code
BRD-K04548931	[0,1,0,0,0,0\|0,0,0]=1

lincs (1)

vendor_id	similarity_code
BRD-K92093830	[0,1,0,0,0,0\|0,0,0]=1

mce (1)

vendor_id	similarity_code
HY-138645	[0,0,0,0,0,0\|1,0,0]=1

mcep (1)

vendor_id	similarity_code
HY-138645A	[0,0,0,0,0,0\|1,0,0]=1

mce (1)

vendor_id	similarity_code
HY-13624A	[0,1,0,0,0,0\|0,0,0]=1

mcee (1)

vendor_id	similarity_code
HY-13624	[0,1,0,0,0,0\|0,0,0]=1

mcep (1)

vendor_id	similarity_code
HY-13624AR	[0,1,0,0,0,0\|0,0,0]=1

oakwoode (1)

vendor_id	similarity_code
021790	[0,1,0,0,0,0\|0,0,0]=1

pdb (1)

vendor_id	similarity_code
DM3	[1,0,0,0,0,0\|0,0,0]=1

pdb (1)

vendor_id	similarity_code
DM8	[0,1,0,0,0,0\|0,0,0]=1

targetmolbio (1)

vendor_id	similarity_code
T0125	[0,1,0,0,0,0\|0,0,0]=1

targetmolbio (1)

vendor_id	similarity_code
T1020	[0,1,0,0,0,0\|0,0,0]=1

targetmolnp (1)

vendor_id	similarity_code
T1020	[0,1,0,0,0,0\|0,0,0]=1

tetrahedronbb (2)

vendor_id	similarity_code
TS83703	[0,1,0,0,0,0\|0,0,0]=1
TS93905	[0,1,0,0,0,0\|0,0,0]=1

tocris (1)

vendor_id	similarity_code
3260	[0,1,0,0,0,0\|0,0,0]=1

34 unique SMILES at similarity level 2

1pchembb (1)

vendor_id	similarity_code
1P019G9T	[2,0,0,0,0,0\|0,0,0]=2

abovchem (1)

vendor_id	similarity_code
HY-17381	[2,0,0,0,0,0\|0,0,0]=2

achemblock (1)

vendor_id	similarity_code
10535	[2,0,0,0,0,0\|0,0,0]=2

akscie-v (1)

vendor_id	similarity_code
C778	[2,0,0,0,0,0\|0,0,0]=2

akscip-v (1)

vendor_id	similarity_code
C828	[2,0,0,0,0,0\|0,0,0]=2

apichem (1)

vendor_id	similarity_code
AC-5255	[2,0,0,0,0,0\|0,0,0]=2

chemyuhao (1)

vendor_id	similarity_code
LT7903	[2,0,0,0,0,0\|0,0,0]=2

aladdinsci (1)

vendor_id	similarity_code
I129863	[2,0,0,0,0,0\|0,0,0]=2

pipharm (1)

vendor_id	similarity_code
PI-21788	[2,0,0,0,0,0\|0,0,0]=2

selleck (3)

vendor_id	similarity_code
S1228	[2,0,0,0,0,0\|0,0,0]=2
S1228	[2,0,0,0,0,0\|0,0,0]=2
S1228	[2,0,0,0,0,0\|0,0,0]=2

apexbt (1)

vendor_id	similarity_code
AMY22178	[2,0,0,0,0,0\|0,0,0]=2

apexmol (1)

vendor_id	similarity_code
AMY22178	[2,0,0,0,0,0\|0,0,0]=2

apichem (1)

vendor_id	similarity_code
AC-9384	[2,0,0,0,0,0\|0,0,0]=2

chemyuhao (1)

vendor_id	similarity_code
RT13486	[2,0,0,0,0,0\|0,0,0]=2

molnova (1)

vendor_id	similarity_code
M15119	[2,0,0,0,0,0\|0,0,0]=2

astatechp (1)

vendor_id	similarity_code
40671	[2,0,0,0,0,0\|0,0,0]=2

excenen (1)

vendor_id	similarity_code
EX-A1148	[2,0,0,0,0,0\|0,0,0]=2

bioaustralis (1)

vendor_id	similarity_code
BIA-E2320	[0,1,0,0,0,0\|0,0,1]=2

bioaustralis (1)

vendor_id	similarity_code
BIA-D1202	[0,1,0,0,0,0\|0,0,1]=2

boerchembb (1)

vendor_id	similarity_code
BC225326	[2,0,0,0,0,0\|0,0,0]=2

cayman (1)

vendor_id	similarity_code
14176	[2,0,0,0,0,0\|0,0,0]=2

chebi (1)

vendor_id	similarity_code
CHEBI:42068	[2,0,0,0,0,0\|0,0,0]=2

pdb (1)

vendor_id	similarity_code
DM5	[2,0,0,0,0,0\|0,0,0]=2

bosche (1)

vendor_id	similarity_code
M2046	[2,0,0,0,0,0\|0,0,0]=2

chebi (1)

vendor_id	similarity_code
CHEBI:31059	[0,0,0,0,0,0\|0,0,2]=2

chebi (1)

vendor_id	similarity_code
CHEBI:31031	[0,0,0,0,0,0\|0,0,2]=2

chebi (1)

vendor_id	similarity_code
CHEBI:31057	[1,0,0,0,0,0\|0,0,1]=2

chebi (1)

vendor_id	similarity_code
CHEBI:75730	[1,0,0,0,0,0\|0,0,1]=2

chebi (1)

vendor_id	similarity_code
CHEBI:41983	[0,1,0,0,0,0\|0,0,1]=2

pdb (1)

vendor_id	similarity_code
DM6	[0,1,0,0,0,0\|0,0,1]=2

chebi (1)

vendor_id	similarity_code
CHEBI:47897	[0,1,0,0,0,0\|1,0,0]=2

chebi (1)

vendor_id	similarity_code
CHEBI:64816	[0,1,0,0,0,0\|0,0,1]=2

dball (1)

vendor_id	similarity_code
DB13103	[0,1,0,0,0,0\|1,0,0]=2

dbin (1)

vendor_id	similarity_code
DB13103	[0,1,0,0,0,0\|1,0,0]=2

dball (1)

vendor_id	similarity_code
DB01177	[2,0,0,0,0,0\|0,0,0]=2

dbap (1)

vendor_id	similarity_code
DB01177	[2,0,0,0,0,0\|0,0,0]=2

keggdviapc (2)

vendor_id	similarity_code
D01747	[2,0,0,0,0,0\|0,0,0]=2
D08062	[2,0,0,0,0,0\|0,0,0]=2

urine (1)

vendor_id	similarity_code
HMDB0015308	[2,0,0,0,0,0\|0,0,0]=2

dbfda (1)

vendor_id	similarity_code
DB01177	[2,0,0,0,0,0\|0,0,0]=2

fda (1)

vendor_id	similarity_code
DB01177	[2,0,0,0,0,0\|0,0,0]=2

hmdbdrug (1)

vendor_id	similarity_code
HMDB0015308	[2,0,0,0,0,0\|0,0,0]=2

hairui (2)

vendor_id	similarity_code
HR129566	[2,0,0,0,0,0\|0,0,0]=2
HR134942	[2,0,0,0,0,0\|0,0,0]=2

keggcviapc (1)

vendor_id	similarity_code
C12433	[0,0,0,0,0,0\|0,0,2]=2

keggcviapc (1)

vendor_id	similarity_code
C12430	[0,0,0,0,0,0\|0,0,2]=2

keggcviapc (1)

vendor_id	similarity_code
C12429	[1,0,0,0,0,0\|0,0,1]=2

keggdviapc (1)

vendor_id	similarity_code
D04067	[1,1,0,0,0,0\|0,0,0]=2

labseekerbb (1)

vendor_id	similarity_code
SC-25438	[2,0,0,0,0,0\|0,0,0]=2

struchembb (2)

vendor_id	similarity_code
SC-17016	[2,0,0,0,0,0\|0,0,0]=2
SC-25438	[2,0,0,0,0,0\|0,0,0]=2

lincs (1)

vendor_id	similarity_code
BRD-K17210248	[0,0,0,0,0,0\|2,0,0]=2

lincs (1)

vendor_id	similarity_code
BRD-A71390734	[2,0,0,0,0,0\|0,0,0]=2

lincs (1)

vendor_id	similarity_code
BRD-K85853281	[2,0,0,0,0,0\|0,0,0]=2

lincs (1)

vendor_id	similarity_code
BRD-K69650333	[2,0,0,0,0,0\|0,0,0]=2

mcee (2)

vendor_id	similarity_code
HY-17381	[2,0,0,0,0,0\|0,0,0]=2
HY-17381A	[2,0,0,0,0,0\|0,0,0]=2

molnova (1)

vendor_id	similarity_code
M15179	[2,0,0,0,0,0\|0,0,0]=2

tetrahedronbb (1)

vendor_id	similarity_code
TS73005	[0,0,0,0,0,0\|0,0,2]=2

19 unique SMILES at similarity level 3

bcp (1)

vendor_id	similarity_code
BCP01380	[0,0,0,0,0,0\|0,0,3]=3

bcp (1)

vendor_id	similarity_code
BCP07859	[1,0,0,0,0,0\|0,0,2]=3

bcp (2)

vendor_id	similarity_code
BCP02858	[0,1,0,0,0,0\|0,0,2]=3
BCP07239	[0,1,0,0,0,0\|0,0,2]=3

chebi (1)

vendor_id	similarity_code
CHEBI:75296	[0,0,0,0,0,0\|0,0,3]=3

chebi (1)

vendor_id	similarity_code
CHEBI:75297	[1,0,0,0,0,0\|0,0,2]=3

chebi (1)

vendor_id	similarity_code
CHEBI:42037	[0,1,0,0,0,0\|1,0,1]=3

pdb (1)

vendor_id	similarity_code
DM7	[0,1,0,0,0,0\|1,0,1]=3

chebi (1)

vendor_id	similarity_code
CHEBI:133817	[0,1,0,0,0,0\|0,0,2]=3

synchemug (1)

vendor_id	similarity_code
fd132	[0,1,0,0,0,0\|0,0,2]=3

tetrahedronbb (1)

vendor_id	similarity_code
TS73148	[0,1,0,0,0,0\|0,0,2]=3

dball (1)

vendor_id	similarity_code
DB05706	[1,1,0,0,0,0\|0,0,1]=3

dbin (1)

vendor_id	similarity_code
DB05706	[1,1,0,0,0,0\|0,0,1]=3

hmdbdrug (1)

vendor_id	similarity_code
HMDB0041884	[0,1,0,0,0,0\|0,0,2]=3

hmdbendo (1)

vendor_id	similarity_code
HMDB0041884	[0,1,0,0,0,0\|0,0,2]=3

hmdbmetab (1)

vendor_id	similarity_code
HMDB0041884	[0,1,0,0,0,0\|0,0,2]=3

hmdbdrug (1)

vendor_id	similarity_code
HMDB0060823	[0,1,0,0,0,0\|0,0,2]=3

hmdbmetab (1)

vendor_id	similarity_code
HMDB0060823	[0,1,0,0,0,0\|0,0,2]=3

keggcviapc (1)

vendor_id	similarity_code
C12431	[1,0,0,0,0,0\|0,0,2]=3

keggcviapc (1)

vendor_id	similarity_code
C12428	[2,0,0,0,0,0\|0,0,1]=3

mce-v (1)

vendor_id	similarity_code
HY-W744872	[0,1,0,0,0,0\|0,0,2]=3

mce (1)

vendor_id	similarity_code
HY-126954	[2,0,0,0,0,0\|0,0,1]=3

mcep (1)

vendor_id	similarity_code
HY-G0022	[0,1,0,0,0,0\|0,0,2]=3

targetmol (1)

vendor_id	similarity_code
T24968	[2,0,0,0,0,0\|0,0,1]=3

tetrahedronbb (1)

vendor_id	similarity_code
TS73149	[0,1,0,0,0,0\|0,0,2]=3

urine (1)

vendor_id	similarity_code
HMDB0041884	[0,1,0,0,0,0\|0,0,2]=3

urine (1)

vendor_id	similarity_code
HMDB0060823	[0,1,0,0,0,0\|0,0,2]=3

4 unique SMILES at similarity level 4

astatechp-v (1)

vendor_id	similarity_code
AT24456	[1,1,0,0,0,0\|0,0,2]=4

bcp (1)

vendor_id	similarity_code
BCP22036	[0,0,0,0,0,0\|0,0,4]=4

bcp (1)

vendor_id	similarity_code
BCP02082	[0,1,0,0,0,0\|0,0,3]=4

bcp (2)

vendor_id	similarity_code
BCP01381	[2,0,0,0,0,0\|0,0,2]=4
BCP10471	[2,0,0,0,0,0\|0,0,2]=4