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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00329062

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
1242-(2-HYDROXY-PHENYL)-1H-INDOLE-
5-CARBOXAMIDINE
A1GI60.73
3IB3-INDOLEBUTYRIC ACIDA,B2AY60.81
3IB3-INDOLEBUTYRIC ACIDA,B,C,E2GJ60.81
1TQ6-(FORMYLAMINO)-7-HYDROXY-L-TRYPTOPHAND,H2OK60.7
1TQ6-(FORMYLAMINO)-7-HYDROXY-L-TRYPTOPHAND,H2I0R0.7
3733-(5-{[4-(AMINOMETHYL)PIPERIDIN-
1-YL]METHYL}-1H-INDOL-2-YL)QUINOLIN-
2(1H)-ONE
A2HXQ0.71
1157-[3-(4-FLUORO-PHENYL)-1-ISOPROPYL-
1H-INDOL-2-YL]-3,5-DIHYDROXY-HEPTANOIC ACID
A,B,C,D1HWI0.71
1177-[2-(4-FLUORO-PHENYL)-5-ISOPROPYL-
3-PHENYL-4-PHENYLCARBAMOYL-PYRROL-
1-YL]- 3,5-DIHYDROXY-HEPTANOIC ACID
A,B,C,D1HWK0.7
4IN4-AMINO-L-TRYPTOPHANA,B2HXX0.76
4IN4-AMINO-L-TRYPTOPHANA1OXF0.76
2S2(2S)-2-(1H-indol-3-yl)hexanoic acidB3C6O0.81
22M2-(2-METHYLPHENYL)-1H-INDOLE-6-
CARBOXIMIDAMIDE
A2G5V0.72
2MI2-METHYL-1H-INDOLEA2PIO0.76
2S8(2S)-8-[(tert-butoxycarbonyl)amino]-
2-(1H-indol-3-yl)octanoic acid
B3C6N0.77
4FW4-FLUOROTRYPTOPHANEA1RM90.76
1IQ2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5-
DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE-
3-CARBOXYLIC ACID
A1Z8N0.75
3IL3-(INDOL-3-YL) LACTATEA2A7P0.77
238A2PRH0.73
4HT4-HYDROXYTRYPTOPHANH,L1RU90.76
4HT4-HYDROXYTRYPTOPHANH,L1RUM0.76
4HT4-HYDROXYTRYPTOPHANH,L1RUL0.76
4HT4-HYDROXYTRYPTOPHANH,L1RUA0.76
0AF7-hydroxy-L-tryptophanL1MAE0.72
0AF7-hydroxy-L-tryptophanL1MAF0.72
23M2-(3-METHYLPHENYL)-1H-INDOLE-5-
CARBOXIMIDAMIDE
A2G5N0.72
2S3(2S)-2-(1H-indol-3-yl)pentanoic acidB3C6P0.82