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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02324435

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AC6P-HYDROXYACETOPHENONEA2GQ80.73
AC6P-HYDROXYACETOPHENONEX2O480.73
1LPTRANYLCYPROMINEA,B1OJB0.71
5646-(5,5,8,8-TETRAMETHYL-5,6,7,8-
TETRAHYDRO-NAPHTALENE-2-CARBONYL)-
NAPHTALENE-2-CARBOXYLIC ACID
A1FCY0.72
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MRA0.74
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MNS0.74
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1DTN0.74
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MDR0.74
173BENZOYL-FORMIC ACIDA,B1SZE0.84
ARL7-(3,5-DITERT-BUTYLPHENYL)-3-METHYLOCTA-
2,4,6-TRIENOIC ACID
A1NQ70.71
7912-PHENYLMALONIC ACIDA1O4P0.74
9TA1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)-
ETHYLAMINO]-ANTHRAQUINONE
A,B1FDG0.75
4MA4-METHYLBENZOIC ACIDA,H2HRG0.79
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.76
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.75
5PV5-PHENYLVALERIC ACIDA,B2AY90.81
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.76
B3I2,3,5-TRIIODOBENZOIC ACIDA1BKE0.72
26CA,B2F7I0.74
ANQACENAPHTHENEQUINONEH,J1OAX0.72
4FCA1YSG0.74
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZFK0.76
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZFQ0.76
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1Z9Y0.76
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZH90.76
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZGE0.76
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZGF0.76
AC01-PHENYLETHANONEA1ZK10.83
AC01-PHENYLETHANONEA1ZK40.83