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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02491431

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.81
3NT3-NITROTOLUENEA,B2BMR0.84
3NT3-NITROTOLUENEA,B2HMO0.84
5AN3,5-DIFLUOROANILINEA1LGX0.73
NBENITROSOBENZENEA1LH70.87
NBENITROSOBENZENEA2LH70.87
NBENITROSOBENZENEA2NSS0.87
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.77
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.78
ANLANILINEA2OV40.78
ANLANILINEA1AEE0.78
ANLANILINEA1PPA0.78
ANLANILINEA1HJ90.78
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.78
PNZP-NITRO-BENZYLAMINEA,B2C700.78
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
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.91
NBZNITROBENZENEA,B2BMQ0.94
NBZNITROBENZENEA,B3BGU0.94
1AN2-FLUOROANILINEA1LGW0.75
MB12-chloro-5-nitrobenzenesulfonamideA2QP60.7
NINDINITROPHENYLENEA1RSM0.88
NINDINITROPHENYLENEA1GVY0.88
NINDINITROPHENYLENEA1GW10.88
TNL2,4,6-TRINITROTOLUENEA1GVR0.77
NP2N-(3-AMINOPROPYL)-2-NITROBENZENAMINEA1WUM0.71
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.78
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.8