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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02318697

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3NT3-NITROTOLUENEA,B2BMR0.74
3NT3-NITROTOLUENEA,B2HMO0.74
N2M5-AMINO-NAPHTALENE-2-MONOSULFONATEC,D1HKN0.85
TNL2,4,6-TRINITROTOLUENEA1GVR0.71
ANS5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONIC ACID(DANSYL ACID)H,J1CVW0.82
ANS5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONIC ACID(DANSYL ACID)H,I1A4W0.82
ANS5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONIC ACID(DANSYL ACID)H,I1FPC0.82
ANCANTHRACEN-1-YLAMINEA,B1GT10.7
ANCANTHRACEN-1-YLAMINEA,B1HN20.7
TK42-ACETYLAMINO-NAPTHALENE-1,5-DISULFONIC ACIDH,L1C5C0.74
5NS5-aminonaphthalene-1-sulfonic acidA,B3CFT0.87
NTSNAPHTHALENE TRISULFONATEA1RML0.7
AEN5-(1-SULFONAPHTHYL)-ACETYLAMINO-
ETHYLAMINE
A1RAR0.72
AEN5-(1-SULFONAPHTHYL)-ACETYLAMINO-
ETHYLAMINE
A1RAS0.72
2AN1-ANILINO-8-NAPHTHALENE SULFONATEA,B3CFN0.77
2AN1-ANILINO-8-NAPHTHALENE SULFONATEA,B2ANS0.77
2AN1-ANILINO-8-NAPHTHALENE SULFONATEA,B1OW40.77
2AN1-ANILINO-8-NAPHTHALENE SULFONATEA1EYN0.77
2AN1-ANILINO-8-NAPHTHALENE SULFONATEA,B1TXC0.77
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.73
3CZ(2R)-1-[(4-tert-butylphenyl)sulfonyl]-
2-methyl-4-(4-nitrophenyl)piperazine
A,B3CZR0.71
MNS5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONAMIDEA1OKL0.79
DSY5-(DIMETHYLAMINO)-2-NAPHTHALENESULFONIC ACIDC,D1BDA0.8