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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02129940

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)A2PYZ0.74
DSM3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-
5-YL)-N-METHYLPROPAN-1-AMINE
A2QJU0.74
DSM3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-
5-YL)-N-METHYLPROPAN-1-AMINE
A2QB40.74
4PG1-[4-(2-oxo-2-phenylethyl)phenyl]guanidineU2R2W0.75
1JZ1-[4-(hydroxymethyl)phenyl]guanidineB3FVF0.73
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA,B1EK10.7
CIUN-CYCLOHEXYL-N'-(4-IODOPHENYL)UREAA1VJ50.7
CVICRYSTAL VIOLETA,B,D,E1JTX0.71
1MRN-METHYLANILINEX2OTZ0.72
GASB,H1ETZ0.7
GASH2CGR0.7
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.73
GP61-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREAA1BJU0.74
34A3,4-DIMETHYLANILINEA1L4K0.78
427(R)-1-(4-(4-(HYDROXYMETHYL)-1,3,2-
DIOXABOROLAN-2-YL)PHENYL)GUANIDINE
A1ZMN0.72
AFF2-ACETYLAMINOFLUORENE-3-YLA2GE20.74
BSU1,3-DIPHENYLUREAA3E850.75
BSU1,3-DIPHENYLUREAA2ZJF0.75
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.73
AGBN-(1-ADAMANTYL)-N'-(4-GUANIDINOBENZYL)UREAA1EJN0.75
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.76
264(phenylamino)acetonitrileA2RBN0.7