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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02858420

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AU44,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)A2PYZ0.84
34A3,4-DIMETHYLANILINEA1L4K0.74
264(phenylamino)acetonitrileA2RBN0.8
12Q1-METHYLQUINOLIN-2(1H)-ONEA,B2F640.72
5CYN,N'-(dipropyl)-tetramethylindodicarbocyanineC3BEP0.71
A8BA1ODC0.75
1MRN-METHYLANILINEX2OTZ0.77
271N-methyl-1-phenylmethanamineX2RBT0.71
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.72
2MI2-METHYL-1H-INDOLEA2PIO0.71
468(3S)-N-(3-CHLORO-2-METHYLPHENYL)-
1-CYCLOHEXYL-5-OXOPYRROLIDINE-3-
CARBOXAMIDE
A2H7P0.71
BEP1-ISOBUTOXY-2-PYRROLIDINO-3[N-BENZYLANILINO] PROPANEC1LXF0.74
BEP1-ISOBUTOXY-2-PYRROLIDINO-3[N-BENZYLANILINO] PROPANEA1DTL0.74
566(3S)-1-CYCLOHEXYL-5-OXO-N-PHENYLPYRROLIDINE-
3-CARBOXAMIDE
A2H7I0.73
AFF2-ACETYLAMINOFLUORENE-3-YLA2GE20.73
744(3S)-N-(5-CHLORO-2-METHYLPHENYL)-
1-CYCLOHEXYL-5-OXOPYRROLIDINE-3-
CARBOXAMIDE
A2H7N0.71
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.71
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.71
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.71
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.71
1712-PHENYLAMINO-ETHANESULFONIC ACIDA,B1SXG0.7
34T(3R)-8-(dioxidosulfanyl)-3-methyl-
1,2,3,4-tetrahydroquinoline
H1ETR0.7