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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00016889

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ANLANILINEA2OV40.77
ANLANILINEA1AEE0.77
ANLANILINEA1PPA0.77
ANLANILINEA1HJ90.77
NMQN-METHYL O-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDEA1D1C0.71
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.77
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.77
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.92
NINDINITROPHENYLENEA1RSM0.91
NINDINITROPHENYLENEA1GVY0.91
NINDINITROPHENYLENEA1GW10.91
NP1N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINEA1WUG0.72
1AN2-FLUOROANILINEA1LGW0.74
TNL2,4,6-TRINITROTOLUENEA1GVR0.8
5AN3,5-DIFLUOROANILINEA1LGX0.72
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.82
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.79
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.79
PNZP-NITRO-BENZYLAMINEA,B2C700.79
NBZNITROBENZENEA,B2BMQ0.92
NBZNITROBENZENEA,B3BGU0.92
NBENITROSOBENZENEA1LH70.86
NBENITROSOBENZENEA2LH70.86
NBENITROSOBENZENEA2NSS0.86
3NT3-NITROTOLUENEA,B2BMR0.83
3NT3-NITROTOLUENEA,B2HMO0.83
PHZ1-PHENYLHYDRAZINEA2E2T0.71
PHZ1-PHENYLHYDRAZINED,H2AGL0.71
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.77
4NS4-nitrophenyl sulfateX2ZYU0.7
NP2N-(3-AMINOPROPYL)-2-NITROBENZENAMINEA1WUM0.79
NIT4-NITROANILINEC,D1RMH0.89
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.89
NIT4-NITROANILINEB1VBS0.89
NIT4-NITROANILINEC1V9T0.89
NIT4-NITROANILINEC,D1VBT0.89
NIT4-NITROANILINEB1LOP0.89
NIT4-NITROANILINEC,D1ZKF0.89
NIT4-NITROANILINEB1PIP0.89
MB12-chloro-5-nitrobenzenesulfonamideA2QP60.71