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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03322258

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1TQ6-(FORMYLAMINO)-7-HYDROXY-L-TRYPTOPHAND,H2OK60.75
1TQ6-(FORMYLAMINO)-7-HYDROXY-L-TRYPTOPHAND,H2I0R0.75
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDA,B,C,D1XES0.86
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDB,C,D1XET0.86
6MRN-[(4'-IODOBIPHENYL-4-YL)SULFONYL]-
D-TRYPTOPHAN
A,B2OW00.75
6IN4-(1-BENZYL-3-CARBAMOYLMETHYL-2-
METHYL-1H-INDOL-5-YLOXY)-BUTYRIC ACID
A1DB50.72
3IL3-(INDOL-3-YL) LACTATEA2A7P0.9
3IB3-INDOLEBUTYRIC ACIDA,B2AY60.83
3IB3-INDOLEBUTYRIC ACIDA,B,C,E2GJ60.83
2S2(2S)-2-(1H-indol-3-yl)hexanoic acidB3C6O0.88
4MF1-(2-DEOXY-5-O-PHOSPHONO-BETA-D-
ERYTHRO-PENTOFURANOSYL)-4-METHYL-
1H-INDOLE
C2OXM0.79
4MF1-(2-DEOXY-5-O-PHOSPHONO-BETA-D-
ERYTHRO-PENTOFURANOSYL)-4-METHYL-
1H-INDOLE
B,C2OYT0.79
6CW6-CHLORO-L-TRYPTOPHANB2GV20.79
6CW6-CHLORO-L-TRYPTOPHANA,B2AXI0.79
6CW6-CHLORO-L-TRYPTOPHANA,L,M3FEA0.79
4IN4-AMINO-L-TRYPTOPHANA,B2HXX0.81
4IN4-AMINO-L-TRYPTOPHANA1OXF0.81
0AF7-hydroxy-L-tryptophanL1MAE0.75
0AF7-hydroxy-L-tryptophanL1MAF0.75
1157-[3-(4-FLUORO-PHENYL)-1-ISOPROPYL-
1H-INDOL-2-YL]-3,5-DIHYDROXY-HEPTANOIC ACID
A,B,C,D1HWI0.73
2S8(2S)-8-[(tert-butoxycarbonyl)amino]-
2-(1H-indol-3-yl)octanoic acid
B3C6N0.86
2S3(2S)-2-(1H-indol-3-yl)pentanoic acidB3C6P0.88
3ID3H-INDOLE-5,6-DIOLA1F9B0.72
3ID3H-INDOLE-5,6-DIOLA1OYO0.72
4PPC,L1XKA0.7
4PPA,B,C,D1XKB0.7
2CC3,4-bis(7-chloro-1H-indol-3-yl)-
1H-pyrrole-2,5-dicarboxylic acid
A3A1L0.7
4HT4-HYDROXYTRYPTOPHANH,L1RU90.79
4HT4-HYDROXYTRYPTOPHANH,L1RUM0.79
4HT4-HYDROXYTRYPTOPHANH,L1RUL0.79
4HT4-HYDROXYTRYPTOPHANH,L1RUA0.79
5672-[[(2R)-1-[[(2S)-5-amino-1-[(4-
carbamimidoylphenyl)methylamino]-
1,5-dioxo-pentan-2-yl]amino]-3-
(1H-indol-3-yl)-1-oxo-propan-2-
yl]sulfamoyl]ethanoic acid
H,L2ZWL0.71
4FW4-FLUOROTRYPTOPHANEA1RM90.82