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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02338613

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3NT3-NITROTOLUENEA,B2BMR0.73
3NT3-NITROTOLUENEA,B2HMO0.73
MNP2-(3-NITROPHENYL)ACETIC ACIDB1AI50.71
NID4-NITRO-INDEN-1-ONEA,B1DOH0.73
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.75
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.75
PPNPARA-NITROPHENYLALANINEI1YTJ0.7
TNL2,4,6-TRINITROTOLUENEA1GVR0.7
AAN2-(4-NITROPHENYL)ACETIC ACIDB1AJN0.75
53N3-[5-(3-nitrophenyl)thiophen-2-
yl]propanoic acid
A3DN50.79
SBN2-AMINO-6-(3,5-DIMETHYLPHENYL)SULFONYLBENZONITRILEA1JLQ0.7
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.71
PNZP-NITRO-BENZYLAMINEA,B2C700.71