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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00694844

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PRY2-PROPYL-ANILINEA1OWY0.7
PPNPARA-NITROPHENYLALANINEI1YTJ0.76
AHC4-AMINOHYDROCINNAMIC ACIDA,B2AY10.72
AAN2-(4-NITROPHENYL)ACETIC ACIDB1AJN0.8
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.77
PNZP-NITRO-BENZYLAMINEA,B2C700.77
MNP2-(3-NITROPHENYL)ACETIC ACIDB1AI50.76
PRQ(3S)-3-amino-3-(2-nitrophenyl)propanoic acidC,F,I,L2VE60.75
NINDINITROPHENYLENEA1RSM0.75
NINDINITROPHENYLENEA1GVY0.75
NINDINITROPHENYLENEA1GW10.75
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.74
3AB3-aminobenzamideA,B,C,D3GOY0.73
NBZNITROBENZENEA,B2BMQ0.71
NBZNITROBENZENEA,B3BGU0.71
EBW4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}-
3-OXOPENTYL)-N,N-DIMETHYL-N-PROP-
2-ENYLBENZENAMINIUM
A1E3Q0.72
3NT3-NITROTOLUENEA,B2BMR0.78
3NT3-NITROTOLUENEA,B2HMO0.78
TSNTRICHOSTATIN AA,B1T640.71
TSNTRICHOSTATIN AA,B1C3R0.71
TSNTRICHOSTATIN AA,B,C3F0R0.71
TSNTRICHOSTATIN AA,B,C3C100.71
TNSA,B,L2G2R0.7
TNL2,4,6-TRINITROTOLUENEA1GVR0.84
NID4-NITRO-INDEN-1-ONEA,B1DOH0.82
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.71