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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00945040

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CQA4-[(7-CHLOROQUINOLIN-4-YL)AMINO]-
2-[(DIETHYLAMINO)METHYL]PHENOL
A,B2AOU0.72
55E4-(4-hydroxy-3-methylphenyl)-6-
phenylpyrimidin-2(5H)-one
A3DCV0.71
QUMQUINACRINE MUSTARDA,B1GXF0.71
MON4-(2-{[4-{[3-(4-CHLOROPHENYL)PROPYL]SULFANYL}-
6-(1-PIPERAZINYL)-1,3,5-TRIAZIN-
2-YL]AMINO}ETHYL)PHENOL
A1NDE0.71
1082-(5-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)-
PROPIONIC ACID
A1G3B0.71
1082-(5-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)-
PROPIONIC ACID
A1G3D0.71
IMY1-{[4,5-BIS(4-CHLOROPHENYL)-2-(2-
ISOPROPOXY-4-METHOXYPHENYL)-4,5-
DIHYDRO-1H-IMIDAZOL-1-YL]CARBONYL}PIPERAZINE
A1TTV0.7
L473-[(5S)-1-ACETYL-3-(2-CHLOROPHENYL)-
4,5-DIHYDRO-1H-PYRAZOL-5-YL]PHENOL
A,B1YRS0.75