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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00010688

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
VAFMETHYLVALINEE,I1PPG0.71
HAICYCLOHEXYLAMMONIUM IONA1NAW0.7
HAICYCLOHEXYLAMMONIUM IONA,B2H520.7
HAICYCLOHEXYLAMMONIUM IONA,B1EJD0.7
HAICYCLOHEXYLAMMONIUM IONA,B2HHJ0.7
CHN4-AMINOMETHYL-CYCLOHEXYLAMINEA,I1D9I0.74
B2IISOLEUCINE BORONIC ACIDA,P1P040.76
B2IISOLEUCINE BORONIC ACIDE,I5EST0.76
IBN2-METHYLPROPAN-1-AMINEA,B2QDY0.77
AMLAMYLAMINEA1JIR0.74
1CBCYCLOPENTANAMINEA2AS60.72
LEN3-METHYLBUTAN-1-AMINEA1PE50.85
LEN3-METHYLBUTAN-1-AMINEA1PE70.85
LEN3-METHYLBUTAN-1-AMINEA1PE80.85
DCI2-METHYL-BUTYLAMINEE,I1ENT0.85
DCI2-METHYL-BUTYLAMINEA,I1GVW0.85
DCI2-METHYL-BUTYLAMINEE1EPP0.85
DCI2-METHYL-BUTYLAMINEI4ER10.85
BLELEUCINE BORONIC ACIDA,P1GBL0.76
BLELEUCINE BORONIC ACIDA,P9LPR0.76
BLELEUCINE BORONIC ACIDA,P7LPR0.76
BLELEUCINE BORONIC ACIDA,P1GBC0.76
BLELEUCINE BORONIC ACIDA,P1GBH0.76
CDE1,2-DIMETHYL-PROPYLAMINEC1B0R0.88
LEM(3S)-3-amino-5-methylhexan-2-oneA,C2ZKS0.7
LEM(3S)-3-amino-5-methylhexan-2-oneI5ER10.7
LYTBUTYLAMINEA1EAG0.73
2MHcis-4-methylcyclohexanamineA,B,C2PT90.81