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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03047558

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
5MB5-METHYLBENZIMIDAZOLEA1JHM0.71
22M2-(2-METHYLPHENYL)-1H-INDOLE-6-
CARBOXIMIDAMIDE
A2G5V0.79
2S8(2S)-8-[(tert-butoxycarbonyl)amino]-
2-(1H-indol-3-yl)octanoic acid
B3C6N0.71
5IQISOQUINOLIN-5-AMINEA,B2F2T0.76
5BN5-[(2-AMINOETHYL)AMINO]-6-FLUORO-
3-(1H-PYRROL-2-YL)BENZO[CD]INDOL-
2(1H)-ONE
A1P2A0.75
2S3(2S)-2-(1H-indol-3-yl)pentanoic acidB3C6P0.75
4IN4-AMINO-L-TRYPTOPHANA,B2HXX0.76
4IN4-AMINO-L-TRYPTOPHANA1OXF0.76
23M2-(3-METHYLPHENYL)-1H-INDOLE-5-
CARBOXIMIDAMIDE
A2G5N0.79
3IB3-INDOLEBUTYRIC ACIDA,B2AY60.8
3IB3-INDOLEBUTYRIC ACIDA,B,C,E2GJ60.8
0471-CYCLOHEXYL-N-{[1-(4-METHYLPHENYL)-
1H-INDOL-3-YL]METHYL}METHANAMINE
A,B2PJL0.84
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDA,B,C,D1XES0.76
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDB,C,D1XET0.76
11XN-(pyridin-3-ylmethyl)anilineA3EJ00.75
6CW6-CHLORO-L-TRYPTOPHANB2GV20.73
6CW6-CHLORO-L-TRYPTOPHANA,B2AXI0.73
6CW6-CHLORO-L-TRYPTOPHANA,L,M3FEA0.73
5171-{2-OXO-3-[(1R)-1-(1H-PYRROL-2-
YL)ETHYL]-2H-INDOL-5-YL}UREA
A2PE10.72
2S2(2S)-2-(1H-indol-3-yl)hexanoic acidB3C6O0.75
3IL3-(INDOL-3-YL) LACTATEA2A7P0.73
3LP1-(CYCLOHEXYLAMINO)-3-(6-METHYL-
3,4-DIHYDRO-1H-CARBAZOL-9(2H)-YL)PROPAN-
2-OL
A,B,C,D,E,F2P6G0.73
4FW4-FLUOROTRYPTOPHANEA1RM90.8
2MI2-METHYL-1H-INDOLEA2PIO0.83
2PT1-[2-(ACRIDIN-9-YLAMINO)ETHYL]-
1,3-DIMETHYLTHIOUREA-PLATINUM(II)-
ETHANE-1,2-DIAMINE
B1XRW0.71