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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00015502

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.72
NIT4-NITROANILINEC,D1RMH0.94
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.94
NIT4-NITROANILINEB1VBS0.94
NIT4-NITROANILINEC1V9T0.94
NIT4-NITROANILINEC,D1VBT0.94
NIT4-NITROANILINEB1LOP0.94
NIT4-NITROANILINEC,D1ZKF0.94
NIT4-NITROANILINEB1PIP0.94
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.77
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.82
NP1N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINEA1WUG0.75
SANSULFANILAMIDEA1AJ00.72
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.73
1AN2-FLUOROANILINEA1LGW0.78
NBZNITROBENZENEA,B2BMQ0.9
NBZNITROBENZENEA,B3BGU0.9
PHZ1-PHENYLHYDRAZINEA2E2T0.75
PHZ1-PHENYLHYDRAZINED,H2AGL0.75
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.75
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.72
PRY2-PROPYL-ANILINEA1OWY0.71
NINDINITROPHENYLENEA1RSM0.87
NINDINITROPHENYLENEA1GVY0.87
NINDINITROPHENYLENEA1GW10.87
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.86
NP2N-(3-AMINOPROPYL)-2-NITROBENZENAMINEA1WUM0.83
TNL2,4,6-TRINITROTOLUENEA1GVR0.77
ANLANILINEA2OV40.81
ANLANILINEA1AEE0.81
ANLANILINEA1PPA0.81
ANLANILINEA1HJ90.81
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.71
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.71
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.71
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.71
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.82
PNZP-NITRO-BENZYLAMINEA,B2C700.82
ONPO-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDEA1D0Y0.71
5AN3,5-DIFLUOROANILINEA1LGX0.76
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.82
3NT3-NITROTOLUENEA,B2BMR0.81
3NT3-NITROTOLUENEA,B2HMO0.81
NBENITROSOBENZENEA1LH70.84
NBENITROSOBENZENEA2LH70.84
NBENITROSOBENZENEA2NSS0.84
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.88
PHJN-[(AMINOOXY)CARBONYL]-N-PHENYLAMINEA,B1UR90.73
1MRN-METHYLANILINEX2OTZ0.71