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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00259153

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2S8(2S)-8-[(tert-butoxycarbonyl)amino]-
2-(1H-indol-3-yl)octanoic acid
B3C6N0.81
3IL3-(INDOL-3-YL) LACTATEA2A7P0.81
4IN4-AMINO-L-TRYPTOPHANA,B2HXX0.8
4IN4-AMINO-L-TRYPTOPHANA1OXF0.8
3IB3-INDOLEBUTYRIC ACIDA,B2AY60.82
3IB3-INDOLEBUTYRIC ACIDA,B,C,E2GJ60.82
678(3-{5-[AMINO(IMINIO)METHYL]-1H-
INDOL-2-YL}-5-BROMO-4-OXIDOPHENYL)ACETATE
A1O3L0.74
1157-[3-(4-FLUORO-PHENYL)-1-ISOPROPYL-
1H-INDOL-2-YL]-3,5-DIHYDROXY-HEPTANOIC ACID
A,B,C,D1HWI0.71
1242-(2-HYDROXY-PHENYL)-1H-INDOLE-
5-CARBOXAMIDINE
A1GI60.7
1CPCOPROPORPHYRIN IA1R3S0.72
1CPCOPROPORPHYRIN IA1R3V0.72
1CPCOPROPORPHYRIN IA1R3Q0.72
5BN5-[(2-AMINOETHYL)AMINO]-6-FLUORO-
3-(1H-PYRROL-2-YL)BENZO[CD]INDOL-
2(1H)-ONE
A1P2A0.7
6963-{5-[AMINO(IMINIO)METHYL]-1H-INDOL-
2-YL}-1,1'-BIPHENYL-2-OLATE
A1O3G0.72
6963-{5-[AMINO(IMINIO)METHYL]-1H-INDOL-
2-YL}-1,1'-BIPHENYL-2-OLATE
A1O3E0.72
6963-{5-[AMINO(IMINIO)METHYL]-1H-INDOL-
2-YL}-1,1'-BIPHENYL-2-OLATE
H,I1O2G0.72
6963-{5-[AMINO(IMINIO)METHYL]-1H-INDOL-
2-YL}-1,1'-BIPHENYL-2-OLATE
B1O5A0.72
6963-{5-[AMINO(IMINIO)METHYL]-1H-INDOL-
2-YL}-1,1'-BIPHENYL-2-OLATE
A1O3F0.72
23M2-(3-METHYLPHENYL)-1H-INDOLE-5-
CARBOXIMIDAMIDE
A2G5N0.73
2MI2-METHYL-1H-INDOLEA2PIO0.76
2S3(2S)-2-(1H-indol-3-yl)pentanoic acidB3C6P0.87
22M2-(2-METHYLPHENYL)-1H-INDOLE-6-
CARBOXIMIDAMIDE
A2G5V0.75
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDA,B,C,D1XES0.83
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDB,C,D1XET0.83
4HT4-HYDROXYTRYPTOPHANH,L1RU90.76
4HT4-HYDROXYTRYPTOPHANH,L1RUM0.76
4HT4-HYDROXYTRYPTOPHANH,L1RUL0.76
4HT4-HYDROXYTRYPTOPHANH,L1RUA0.76
6CW6-CHLORO-L-TRYPTOPHANB2GV20.77
6CW6-CHLORO-L-TRYPTOPHANA,B2AXI0.77
6CW6-CHLORO-L-TRYPTOPHANA,L,M3FEA0.77
4FW4-FLUOROTRYPTOPHANEA1RM90.8
0AF7-hydroxy-L-tryptophanL1MAE0.72
0AF7-hydroxy-L-tryptophanL1MAF0.72
2S2(2S)-2-(1H-indol-3-yl)hexanoic acidB3C6O0.86