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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00073919

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDA,B,C,D1XES0.78
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDB,C,D1XET0.78
2MI2-METHYL-1H-INDOLEA2PIO0.78
4FW4-FLUOROTRYPTOPHANEA1RM90.77
3IB3-INDOLEBUTYRIC ACIDA,B2AY60.82
3IB3-INDOLEBUTYRIC ACIDA,B,C,E2GJ60.82
9AC9-ACRIDINECARBONYLA,B,G,J,K,L,M1G3X0.71
2S2(2S)-2-(1H-indol-3-yl)hexanoic acidB3C6O0.79
1157-[3-(4-FLUORO-PHENYL)-1-ISOPROPYL-
1H-INDOL-2-YL]-3,5-DIHYDROXY-HEPTANOIC ACID
A,B,C,D1HWI0.71
1CPCOPROPORPHYRIN IA1R3S0.72
1CPCOPROPORPHYRIN IA1R3V0.72
1CPCOPROPORPHYRIN IA1R3Q0.72
4IN4-AMINO-L-TRYPTOPHANA,B2HXX0.76
4IN4-AMINO-L-TRYPTOPHANA1OXF0.76
9CA9H-CARBAZOLEA,B,C,D,E,F2DE70.75
6CW6-CHLORO-L-TRYPTOPHANB2GV20.73
6CW6-CHLORO-L-TRYPTOPHANA,B2AXI0.73
6CW6-CHLORO-L-TRYPTOPHANA,L,M3FEA0.73
23M2-(3-METHYLPHENYL)-1H-INDOLE-5-
CARBOXIMIDAMIDE
A2G5N0.73
2S3(2S)-2-(1H-indol-3-yl)pentanoic acidB3C6P0.79
39Z5-HYDROXY-3-[(1R)-1-(1H-PYRROL-
2-YL)ETHYL]-2H-INDOL-2-ONE
A2PE00.7
678(3-{5-[AMINO(IMINIO)METHYL]-1H-
INDOL-2-YL}-5-BROMO-4-OXIDOPHENYL)ACETATE
A1O3L0.71
AGE(2E)-N-hydroxy-3-[1-methyl-4-(phenylacetyl)-
1H-pyrrol-2-yl]prop-2-enamide
A,B,C3F070.72
3IL3-(INDOL-3-YL) LACTATEA2A7P0.75
5171-{2-OXO-3-[(1R)-1-(1H-PYRROL-2-
YL)ETHYL]-2H-INDOL-5-YL}UREA
A2PE10.74
2S8(2S)-8-[(tert-butoxycarbonyl)amino]-
2-(1H-indol-3-yl)octanoic acid
B3C6N0.74
22M2-(2-METHYLPHENYL)-1H-INDOLE-6-
CARBOXIMIDAMIDE
A2G5V0.73