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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02250407

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BHOBENZHYDROXAMIC ACIDA,B1GX20.73
BHOBENZHYDROXAMIC ACIDA1HSR0.73
BHOBENZHYDROXAMIC ACIDA,B2ATJ0.73
BHOBENZHYDROXAMIC ACIDA,B4ATJ0.73
BHOBENZHYDROXAMIC ACIDA,B3ATJ0.73
BHOBENZHYDROXAMIC ACIDA3GCK0.73
BHOBENZHYDROXAMIC ACIDA,B,C,D,E,F,
G,H
2BOY0.73
AHC4-AMINOHYDROCINNAMIC ACIDA,B2AY10.72
3AB3-aminobenzamideA,B,C,D3GOY0.77
TSNTRICHOSTATIN AA,B1T640.8
TSNTRICHOSTATIN AA,B1C3R0.8
TSNTRICHOSTATIN AA,B,C3F0R0.8
TSNTRICHOSTATIN AA,B,C3C100.8
EBW4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}-
3-OXOPENTYL)-N,N-DIMETHYL-N-PROP-
2-ENYLBENZENAMINIUM
A1E3Q0.7
PRQ(3S)-3-amino-3-(2-nitrophenyl)propanoic acidC,F,I,L2VE60.72
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.74
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.75
PNZP-NITRO-BENZYLAMINEA,B2C700.75
NBZNITROBENZENEA,B2BMQ0.71
NBZNITROBENZENEA,B3BGU0.71
3NT3-NITROTOLUENEA,B2BMR0.78
3NT3-NITROTOLUENEA,B2HMO0.78
MNP2-(3-NITROPHENYL)ACETIC ACIDB1AI50.77
BVATRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATEB,C2P8O0.71
NID4-NITRO-INDEN-1-ONEA,B1DOH0.87
GW92-chloro-5-nitro-N-phenylbenzamideA,D3E000.71
PAB4-AMINOBENZOIC ACIDA1PBD0.7
PAB4-AMINOBENZOIC ACIDB2DZA0.7
PAB4-AMINOBENZOIC ACIDA1IUS0.7
PAB4-AMINOBENZOIC ACIDA1IUU0.7
PAB4-AMINOBENZOIC ACIDA1IUT0.7
4NB4-NITROBENZOIC ACIDA,B3CHT0.78
PPNPARA-NITROPHENYLALANINEI1YTJ0.73
AAN2-(4-NITROPHENYL)ACETIC ACIDB1AJN0.78
KY14-(2-AMINOPHENYL)-4-OXOBUTANOIC ACIDA,B,C,D2CH20.73
4PG1-[4-(2-oxo-2-phenylethyl)phenyl]guanidineU2R2W0.71
TNL2,4,6-TRINITROTOLUENEA1GVR0.74
APZ4-AMINOPHTHALHYDRAZIDEA1ENU0.71