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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00700888

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PEM2-[P-[2-P-CHLOROBENZAMIDO)ETHYL]PHENOXY]-
2-METHYLPROPIONIC ACID
A,B1IWH0.71
GFA2-[4-chloro-2-(phenylcarbonyl)phenoxy]-
N-phenylacetamide
A3DLE0.72
T76(6R,21AS)-17-CHLORO-6-CYCLOHEXYL-
2,3,6,7,10,11,19,20-OCTAHYDRO-1H,5H-
PYRROLO[1,2-K][1,4,8,11,14]BENZOXATETRAAZA-
CYCLOHEPTADECINE-5,8,12,21(9H,13H,21AH)-
TETRONE
A,H1NT10.73
ZHZ2-(4-METHOXYPHENYL)ACETAMIDED,H2HKR0.74
TF3N-(2-AMINOETHYL)-2-{3-CHLORO-4-
[(4-ISOPROPYLBENZYL)OXY]PHENYL} ACETAMIDE
A2BU70.75
CBCN'-(5-CHLOROBENZOFURAN-2-CARBONYL)-
2-(TRIFLUOROMETHYL)BENZENESULFONOHYDRAZIDE
A,D,G,J2ABJ0.72
YE65-(2-chlorophenyl)furan-2-carbohydrazideA2P9A0.78
YE65-(2-chlorophenyl)furan-2-carbohydrazideA2P990.78
PDZ6-(4-chloro-2-fluoro-3-phenoxybenzyl)pyridazin-
3(2H)-one
A3DI60.72
34C(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACIDA,B1HT80.7
GRR(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acidA3CDS0.7
YRG(2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acidA3CDP0.77
CBP2-{4-[4-(4-CHLORO-PHENOXY)-BENZENESULFONYL]-
TETRAHYDRO-PYRAN-4-YL}-N-HYDROXY-
ACETAMIDE
A,B456C0.71
CBP2-{4-[4-(4-CHLORO-PHENOXY)-BENZENESULFONYL]-
TETRAHYDRO-PYRAN-4-YL}-N-HYDROXY-
ACETAMIDE
A,B1CXV0.71
1771-[2-AMINO-2-CYCLOHEXYL-ACETYL]-
PYRROLIDINE-3-CARBOXYLIC ACID 5-
CHLORO-2-(2-ETHYLCARBAMOYL-ETHOXY)-
BENZYLAMIDE
A,B1TA60.74