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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00015814

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PH3N-(CHLOROPHENYL)-N'-HYDROXYGUANIDINEA,B1DM60.75
PRY2-PROPYL-ANILINEA1OWY0.7
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.72
I7B4-AMINO-6-CHLOROBENZENE-1,3-DISULFONAMIDEA2POV0.7
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.78
MB12-chloro-5-nitrobenzenesulfonamideA2QP60.73
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.73
1AN2-FLUOROANILINEA1LGW0.78
NINDINITROPHENYLENEA1RSM0.72
NINDINITROPHENYLENEA1GVY0.72
NINDINITROPHENYLENEA1GW10.72
NBENITROSOBENZENEA1LH70.79
NBENITROSOBENZENEA2LH70.79
NBENITROSOBENZENEA2NSS0.79
C1M1-(4-CHLOROPHENYL)-2,3-DIHYDRO-
1H-TETRAZOLE
B,I2C900.74
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.7
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.7
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.7
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.7
PHZ1-PHENYLHYDRAZINEA2E2T0.75
PHZ1-PHENYLHYDRAZINED,H2AGL0.75
1MRN-METHYLANILINEX2OTZ0.7
C2A1-(3-CHLOROPHENYL)METHANAMINEB,I2C8Z0.7
2CM2-CHLORO-6-METHYL-ANILINEA1OVH0.79
NIT4-NITROANILINEC,D1RMH0.72
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.72
NIT4-NITROANILINEB1VBS0.72
NIT4-NITROANILINEC1V9T0.72
NIT4-NITROANILINEC,D1VBT0.72
NIT4-NITROANILINEB1LOP0.72
NIT4-NITROANILINEC,D1ZKF0.72
NIT4-NITROANILINEB1PIP0.72
NBZNITROBENZENEA,B2BMQ0.75
NBZNITROBENZENEA,B3BGU0.75
SDA4-AMINO-3,5-DICHLOROBENZENESULFONAMIDEA1ZGE0.73
ANLANILINEA2OV40.82
ANLANILINEA1AEE0.82
ANLANILINEA1PPA0.82
ANLANILINEA1HJ90.82
5AN3,5-DIFLUOROANILINEA1LGX0.76
C2B1-(4-CHLOROPHENYL)METHANAMINED,H2Q7Q0.7
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.78