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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02413835

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3NT3-NITROTOLUENEA,B2BMR0.74
3NT3-NITROTOLUENEA,B2HMO0.74
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.81
TNL2,4,6-TRINITROTOLUENEA1GVR0.71
NBZNITROBENZENEA,B2BMQ0.82
NBZNITROBENZENEA,B3BGU0.82
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.77
PNZP-NITRO-BENZYLAMINEA,B2C700.77
1AN2-FLUOROANILINEA1LGW0.77
NBENITROSOBENZENEA1LH70.76
NBENITROSOBENZENEA2LH70.76
NBENITROSOBENZENEA2NSS0.76
U134-(4-FLUORO-PHENYLAZO)-5-IMINO-
5H-PYRAZOL-3-YLAMINE
A2GG30.72
NIT4-NITROANILINEC,D1RMH0.88
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.88
NIT4-NITROANILINEB1VBS0.88
NIT4-NITROANILINEC1V9T0.88
NIT4-NITROANILINEC,D1VBT0.88
NIT4-NITROANILINEB1LOP0.88
NIT4-NITROANILINEC,D1ZKF0.88
NIT4-NITROANILINEB1PIP0.88
NP2N-(3-AMINOPROPYL)-2-NITROBENZENAMINEA1WUM0.74
ANLANILINEA2OV40.74
ANLANILINEA1AEE0.74
ANLANILINEA1PPA0.74
ANLANILINEA1HJ90.74
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.7
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.7
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.7
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.7
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.71
5AN3,5-DIFLUOROANILINEA1LGX0.77
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.76
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.71
PHZ1-PHENYLHYDRAZINEA2E2T0.71
PHZ1-PHENYLHYDRAZINED,H2AGL0.71
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.76
NINDINITROPHENYLENEA1RSM0.79
NINDINITROPHENYLENEA1GVY0.79
NINDINITROPHENYLENEA1GW10.79
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.8
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.71