MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02177869

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.

Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
PLT	[3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYL]-L-TRYPTOPHANE	B	2TYS	0.73
EI1	3-ETHYL-2-(4-HYDROXYPHENYL)-2H- INDAZOL-5-OL	A,B	2QAB	0.74
678	(3-{5-[AMINO(IMINIO)METHYL]-1H- INDOL-2-YL}-5-BROMO-4-OXIDOPHENYL)ACETATE	A	1O3L	0.72
TRW	TRW3-(2-AMINO-3-HYDROXY-PROPYL)- 6-(N'-CYCLOHEXYL-HYDRAZINO)OCTAHYDRO- INDOL-7-OL	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	1MG3	0.76
TRW	TRW3-(2-AMINO-3-HYDROXY-PROPYL)- 6-(N'-CYCLOHEXYL-HYDRAZINO)OCTAHYDRO- INDOL-7-OL	A,B,C	1PBY	0.76
4HT	4-HYDROXYTRYPTOPHAN	H,L	1RU9	0.74
4HT	4-HYDROXYTRYPTOPHAN	H,L	1RUM	0.74
4HT	4-HYDROXYTRYPTOPHAN	H,L	1RUL	0.74
4HT	4-HYDROXYTRYPTOPHAN	H,L	1RUA	0.74
130	2-(2-HYDROXY-BIPHENYL)-1H-BENZOIMIDAZOLE- 5-CARBOXAMIDINE	B	1GJB	0.71
130	2-(2-HYDROXY-BIPHENYL)-1H-BENZOIMIDAZOLE- 5-CARBOXAMIDINE	H,I	1GJ5	0.71
130	2-(2-HYDROXY-BIPHENYL)-1H-BENZOIMIDAZOLE- 5-CARBOXAMIDINE	B	1GJC	0.71
IOK	N-[(1R)-3-(4-HYDROXYPHENYL)-1-METHYLPROPYL]- 2-(2-PHENYL-1H-INDOL-3-YL)ACETAMIDE	A,B	2IOK	0.75
KN2	4-(6-HYDROXY-1H-INDAZOL-3-YL)BENZENE- 1,3-DIOL	A,B	2QA6	0.71
824	9-HYDROXY-4-PHENYLPYRROLO[3,4-C]CARBAZOLE- 1,3(2H,6H)-DIONE	A	1X8B	0.72
134	6-FLUORO-2-[2-HYDROXY-3-(2-METHYL- CYCLOHEXYLOXY)-PHENYL]-1H-INDOLE- 5-CARBOXAMIDINE	B	1GJ9	0.71
BMZ	2-(2-HYDROXY-PHENYL)-1H-BENZOIMIDAZOLE- 5-CARBOXAMIDINE	A	1GI0	0.71
BMZ	2-(2-HYDROXY-PHENYL)-1H-BENZOIMIDAZOLE- 5-CARBOXAMIDINE	B	1GI8	0.71
BMZ	2-(2-HYDROXY-PHENYL)-1H-BENZOIMIDAZOLE- 5-CARBOXAMIDINE	H,I	1GHW	0.71
BMZ	2-(2-HYDROXY-PHENYL)-1H-BENZOIMIDAZOLE- 5-CARBOXAMIDINE	A	1GI1	0.71
BMZ	2-(2-HYDROXY-PHENYL)-1H-BENZOIMIDAZOLE- 5-CARBOXAMIDINE	A	1GI3	0.71
BMZ	2-(2-HYDROXY-PHENYL)-1H-BENZOIMIDAZOLE- 5-CARBOXAMIDINE	H,I,L	1GHX	0.71
7NH	[2'-HYDROXY-3'-(1H-PYRROLO[3,2- C]PYRIDIN-2-YL)-BIPHENYL-3-YLMETHYL]- UREA	H	2FLR	0.75
TRX	6-HYDROXYTRYPTOPHAN	A,B,C,I,J,L,M	1K83	0.75
TRX	6-HYDROXYTRYPTOPHAN	A,B,C,I,J,L, M,T	2VUM	0.75
TRX	6-HYDROXYTRYPTOPHAN	A,B,C,I,J,L,M	3CQZ	0.75
EES	3-CHLORO-2-(4-HYDROXYPHENYL)-2H- INDAZOL-5-OL	A,B	2QGW	0.7
IGP	INDOLE-3-GLYCEROL PHOSPHATE	A	1A53	0.7
IGP	INDOLE-3-GLYCEROL PHOSPHATE	A,B	2RHG	0.7
IGP	INDOLE-3-GLYCEROL PHOSPHATE	A,B	1KFB	0.7
IGP	INDOLE-3-GLYCEROL PHOSPHATE	A,B	2RH9	0.7
IGP	INDOLE-3-GLYCEROL PHOSPHATE	A,B	1A5B	0.7
IGP	INDOLE-3-GLYCEROL PHOSPHATE	A,B	1QOQ	0.7
TSC	(1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL	D,H	2AH0	0.71
TSC	(1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL	D,H	2AGZ	0.71
TTQ	6-AMINO-7-HYDROXY-L-TRYPTOPHAN	D,H	2I0S	0.78
TTQ	6-AMINO-7-HYDROXY-L-TRYPTOPHAN	D,H	2HXC	0.78
122	2-(2-HYDROXY-PHENYL)-3H-BENZOIMIDAZOLE- 5-CARBOXAMIDINE	A	1GI4	0.71
122	2-(2-HYDROXY-PHENYL)-3H-BENZOIMIDAZOLE- 5-CARBOXAMIDINE	A	1GI2	0.71
FIC	5-fluoroindole-2-carboxylic acid	A,B	3DWS	0.71
HRP	5-HYDROXY-L-TRYPTOPHAN	B	1YIA	0.73
N1H		H	2F9B	0.75
HRM	7-METHOXY-1-METHYL-9H-BETA-CARBOLINE	A	2Z5X	0.71
HRM	7-METHOXY-1-METHYL-9H-BETA-CARBOLINE	A	2Z5Y	0.71
SIE	SULFAMIC ACID 1-DECYL-2-(4-SULFAMOYLOXYPHENYL)- 1H-INDOL-6-YL ESTER	A	2BRP	0.74
0AF	7-hydroxy-L-tryptophan	L	1MAE	0.74
0AF	7-hydroxy-L-tryptophan	L	1MAF	0.74
SRO	SEROTONIN	A,B	3BRN	0.77
SRO	SEROTONIN	A	2QEH	0.77
124	2-(2-HYDROXY-PHENYL)-1H-INDOLE- 5-CARBOXAMIDINE	A	1GI6	0.83
CR3	2-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-6-(CYCLOPENTYLOXY)BENZENOLATE	A	1O2H	0.71
1TQ	6-(FORMYLAMINO)-7-HYDROXY-L-TRYPTOPHAN	D,H	2OK6	0.76
1TQ	6-(FORMYLAMINO)-7-HYDROXY-L-TRYPTOPHAN	D,H	2I0R	0.76
IOS	3-SULFOOXY-1H-INDOLE	A,B	2BXH	0.77
TRO	2-HYDROXY-TRYPTOPHAN	A	1KB0	0.74
TRO	2-HYDROXY-TRYPTOPHAN	A	1G3P	0.74
QNO	2-NONYL-4-HYDROXYQUINOLINE N-OXIDE	C,D,E	1NU1	0.74
QNO	2-NONYL-4-HYDROXYQUINOLINE N-OXIDE	A,B,C,D,G	2E75	0.74
132	6-CHLORO-2-(2-HYDROXY-BIPHENYL- 3-YL)-1H-INDOLE-5-CARBOXAMIDINE	H	1O5E	0.77
132	6-CHLORO-2-(2-HYDROXY-BIPHENYL- 3-YL)-1H-INDOLE-5-CARBOXAMIDINE	B	1GJ7	0.77
132	6-CHLORO-2-(2-HYDROXY-BIPHENYL- 3-YL)-1H-INDOLE-5-CARBOXAMIDINE	H,I	1GJ4	0.77
132	6-CHLORO-2-(2-HYDROXY-BIPHENYL- 3-YL)-1H-INDOLE-5-CARBOXAMIDINE	A	1GJ6	0.77
3ID	3H-INDOLE-5,6-DIOL	A	1F9B	0.75
3ID	3H-INDOLE-5,6-DIOL	A	1OYO	0.75
ASE	N-ACETYL SEROTONIN	A	1NAS	0.75
HQO	2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE	A,B,C	1KQG	0.74
HQO	2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE	A,B,C,D,E,F	2VR0	0.74
HQO	2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE	A,B,C,M,N,O,P	1KF6	0.74
ML2	N-[2-(2-iodo-5-methoxy-1H-indol- 3-yl)ethyl]acetamide	A,B	2QX9	0.7
ML2	N-[2-(2-iodo-5-methoxy-1H-indol- 3-yl)ethyl]acetamide	A,B	2QX8	0.7
696	3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-1,1'-BIPHENYL-2-OLATE	A	1O3G	0.79
696	3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-1,1'-BIPHENYL-2-OLATE	A	1O3E	0.79
696	3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-1,1'-BIPHENYL-2-OLATE	H,I	1O2G	0.79
696	3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-1,1'-BIPHENYL-2-OLATE	B	1O5A	0.79
696	3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-1,1'-BIPHENYL-2-OLATE	A	1O3F	0.79
783	3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-5-METHOXY-1,1'-BIPHENYL-2- OLATE	A	1O2T	0.73
CAU	(2S)-1-(9H-Carbazol-4-yloxy)-3- (isopropylamino)propan-2-ol	A	2RH1	0.74
907	2-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-6-BROMO-4-METHYLBENZENOLATE	A	1O3I	0.75
907	2-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-6-BROMO-4-METHYLBENZENOLATE	A	1O3H	0.75