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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02224207

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4IN4-AMINO-L-TRYPTOPHANA,B2HXX0.83
4IN4-AMINO-L-TRYPTOPHANA1OXF0.83
2S2(2S)-2-(1H-indol-3-yl)hexanoic acidB3C6O0.9
2S3(2S)-2-(1H-indol-3-yl)pentanoic acidB3C6P0.91
3IL3-(INDOL-3-YL) LACTATEA2A7P0.94
368(1R)-2-{[AMINO(IMINO)METHYL]AMINO}-
1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2-
DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE
A1ZLR0.7
3ID3H-INDOLE-5,6-DIOLA1F9B0.79
3ID3H-INDOLE-5,6-DIOLA1OYO0.79
43A(3Z)-6-(4-HYDROXY-3-METHOXYPHENYL)-
3-(1H-PYRROL-2-YLMETHYLENE)-1,3-
DIHYDRO-2H-INDOL-2-ONE
A2AYP0.73
0AF7-hydroxy-L-tryptophanL1MAE0.81
0AF7-hydroxy-L-tryptophanL1MAF0.81
1242-(2-HYDROXY-PHENYL)-1H-INDOLE-
5-CARBOXAMIDINE
A1GI60.7
4FW4-FLUOROTRYPTOPHANEA1RM90.84
4HT4-HYDROXYTRYPTOPHANH,L1RU90.86
4HT4-HYDROXYTRYPTOPHANH,L1RUM0.86
4HT4-HYDROXYTRYPTOPHANH,L1RUL0.86
4HT4-HYDROXYTRYPTOPHANH,L1RUA0.86
1157-[3-(4-FLUORO-PHENYL)-1-ISOPROPYL-
1H-INDOL-2-YL]-3,5-DIHYDROXY-HEPTANOIC ACID
A,B,C,D1HWI0.73
39Z5-HYDROXY-3-[(1R)-1-(1H-PYRROL-
2-YL)ETHYL]-2H-INDOL-2-ONE
A2PE00.72
1TQ6-(FORMYLAMINO)-7-HYDROXY-L-TRYPTOPHAND,H2OK60.8
1TQ6-(FORMYLAMINO)-7-HYDROXY-L-TRYPTOPHAND,H2I0R0.8
2S8(2S)-8-[(tert-butoxycarbonyl)amino]-
2-(1H-indol-3-yl)octanoic acid
B3C6N0.86
32T(S)-2-AMINO-3-(4H-THIENO[3,2-B]-
PYRROL-6-YL)-PROPIONIC ACID
A1RMO0.71
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDA,B,C,D1XES0.9
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDB,C,D1XET0.9
3IB3-INDOLEBUTYRIC ACIDA,B2AY60.85
3IB3-INDOLEBUTYRIC ACIDA,B,C,E2GJ60.85
2CC3,4-bis(7-chloro-1H-indol-3-yl)-
1H-pyrrole-2,5-dicarboxylic acid
A3A1L0.75
4EA(1S)-2-(1H-INDOL-3-YL)-1-[({5-[(E)-
2-PYRIDIN-4-YLVINYL]PYRIDIN-3-YL}OXY)METHYL]ETHYLAMINE
E2F7X0.7