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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01076074

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CXNCLOXACILLINA,B1FCM0.73
645[1-TERT-BUTYL-3-(2,4-DICHLOROPHENYL)-
5-HYDROXY-1H-PYRAZOL-4-YL][2-CHLORO-
4-(METHYLSULFONYL)PHENYL]METHANONE
A1TG50.72
2D7N-(4-ACETYLPHENYL)-5-(5-CHLORO-
2,4-DIHYDROXYPHENYL)-1H-PYRAZOLE-
4-CARBOXAMIDE
A2BYH0.71
6C36-CHLORO-3-(3-METHYLISOXAZOL-5-
YL)-4-PHENYLQUINOLIN-2(1H)-ONE
A2I0V0.83
PXBparecoxibA2ZMB0.71
136N-(4-CARBAMIMIDOYL-3-CHORO-PHENYL)-
2-HYDROXY-3-IODO-5-METHYL-BENZAMIDE
B1GJD0.78
LI7(3E)-3-[(4-HYDROXYPHENYL)IMINO]-
1H-INDOL-2(3H)-ONE
A1YXX0.73
6792-CHLORO-5-[4-(3-CHLORO-PHENYL)-
2,5-DIOXO-2,5-DIHYDRO-1H-PYRROL-
3-YLAMINO]-BENZOIC ACID
A,B1Q4L0.7
2EQ5-(5-chloro-2,4-dihydroxyphenyl)-
N-ethyl-4-[4-(morpholin-4-ylmethyl)phenyl]isoxazole-
3-carboxamide
A2VCJ0.73
135N-(4-CARBAMIMIDOYL-PHENYL)-2-HYDROXY-
BENZAMIDE
B1GJA0.74
2724-(6-HYDROXY-BENZO[D]ISOXAZOL-3-
YL)BENZENE-1,3-DIOL
A,B,C,D1U3Q0.7
O626-(4-{[3-(2,6-dichlorophenyl)-5-
(1-methylethyl)isoxazol-4-yl]methoxy}phenyl)naphthalene-
1-carboxylic acid
A3DCU0.71
2GJ5-[2,4-DIHYDROXY-5-(1-METHYLETHYL)PHENYL]-
N-ETHYL-4-[4-(MORPHOLIN-4-YLMETHYL)PHENYL]ISOXAZOLE-
3-CARBOXAMIDE
A2VCI0.7
105N-[5-METHYL-3-O-TOLYL-ISOXAZOLE-
4-CARBOXYLIC ACID AMIDE] BORONIC ACID
A1JWZ0.83
105N-[5-METHYL-3-O-TOLYL-ISOXAZOLE-
4-CARBOXYLIC ACID AMIDE] BORONIC ACID
A,B1FSY0.83
105N-[5-METHYL-3-O-TOLYL-ISOXAZOLE-
4-CARBOXYLIC ACID AMIDE] BORONIC ACID
A1NYY0.83
0643-[(E)-2-(2-chloro-4-{[3-(2,6-dichlorophenyl)-
5-(1-methylethyl)isoxazol-4-yl]methoxy}phenyl)ethenyl]benzoic acid
A3DCT0.74
GNI(3-{4-[2-(2,4-DICHLORO-PHENOXY)-
ETHYLCARBAMOYL]-5-PHENYL-ISOXAZOL-
3-YL}-PHENYL)-ACETIC ACID
A,B2J140.76
CXZ4-chloro-6-{5-[(2-morpholin-4-ylethyl)amino]-
1,2-benzisoxazol-3-yl}benzene-1,3-
diol
A3BMY0.73
DZ22,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamideA,B3ESO0.71
2GG5-(5-CHLORO-2,4-DIHYDROXYPHENYL)-
N-ETHYL-4-(4-METHOXYPHENYL)ISOXAZOLE-
3-CARBOXAMIDE
A2UWD0.74
P2C2-[(3,5-DICHLORO-4-TRIOXIDANYLPHENYL)AMINO]BENZOIC ACIDA,B1U210.74
D056-(3,4-DIHYDROXYBENZYL)-3-ETHYL-
1-(2,4,6-TRICHLOROPHENYL)-1H-PYRAZOLO[3,4-
D]PYRIMIDIN-4(5H)-ONE
A2B540.7