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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01083148

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.74
2CM2-CHLORO-6-METHYL-ANILINEA1OVH0.72
2631-(azidomethyl)-3-methylbenzeneX2RB20.73
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.78
BRNBERENILA,B268D0.71
BRNBERENILA,B1D630.71
BRNBERENILA,D,E2GBY0.71
BRNBERENILA2DBE0.71
BRNBERENILA2GVR0.71
3AB3-aminobenzamideA,B,C,D3GOY0.7
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.8
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.78
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.76
1AN2-FLUOROANILINEA1LGW0.73
3NT3-NITROTOLUENEA,B2BMR0.82
3NT3-NITROTOLUENEA,B2HMO0.82
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.76
ANLANILINEA2OV40.76
ANLANILINEA1AEE0.76
ANLANILINEA1PPA0.76
ANLANILINEA1HJ90.76
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.81
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.81
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.81
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.81
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.73
5AN3,5-DIFLUOROANILINEA1LGX0.71
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.8
34A3,4-DIMETHYLANILINEA1L4K0.81
AU44,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)A2PYZ0.71