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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00589861

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NP1N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINEA1WUG0.74
HFTHYDROXYFLUTAMIDEA2AX60.7
12Q1-METHYLQUINOLIN-2(1H)-ONEA,B2F640.77
3NT3-NITROTOLUENEA,B2BMR0.75
3NT3-NITROTOLUENEA,B2HMO0.75
DOF(S)-2-(4-NITROBENZYL)-1,4,7,10-
TETRAAZACYCLODODECANE-N,N',N'',N'''-
TETRAACETATE
A,B,C,D1NC40.76
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.74
TSNTRICHOSTATIN AA,B1T640.71
TSNTRICHOSTATIN AA,B1C3R0.71
TSNTRICHOSTATIN AA,B,C3F0R0.71
TSNTRICHOSTATIN AA,B,C3C100.71
NID4-NITRO-INDEN-1-ONEA,B1DOH0.71
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.79
PNZP-NITRO-BENZYLAMINEA,B2C700.79
AAHH1KEL0.73
AAHB,H1FL60.73
PNCPARA-NITROBENZYL GLUTARYL GLYCINIC ACIDL1YEF0.76
TNSA,B,L2G2R0.72
RA4N-(4-NITROBENZOYL)-L-LEUCYL-N-(4-
{[AMINO(IMINO)METHYL]AMINO}BUTYL)-
L-PROLINAMIDE
H,I1YPM0.74
CLCN-ACETYL-P-NITROPHENYLSERINOLA1GRR0.7
OCHQUINOLIN-2(1H)-ONEA,B,C,D,E,F1Z030.7
TNL2,4,6-TRINITROTOLUENEA1GVR0.73