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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02303874

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1ZN(2S,3S,4E,6E,8S,9S)-3-amino-9-methoxy-
2,6,8-trimethyl-10-phenyldeca-4,6-
dienoic acid
C,F,M,N2IAE0.7
247(3R)-3-amino-2,2-difluoro-3-(4-
hydroxyphenyl)propanoic acid
A,B2QVE0.71
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.86
2013-AMIDO-5-BIPHENYL-BENZOIC ACIDA2B0M0.74
4MB4-[(METHYLSULFONYL)AMINO]BENZOIC ACIDA,B2HDS0.71
3B42-(cyclohexylamino)benzoic acidA,B3B4P0.71
4BF4-BROMO-L-PHENYLALANINEA2AG60.76
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.76
173BENZOYL-FORMIC ACIDA,B1SZE0.72
4MA4-METHYLBENZOIC ACIDA,H2HRG0.75
3FL3-{[(4-{[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-
4-yl)methyl]amino}butyl)amino]methyl}benzoic acid
A,B3FCL0.7
4BA4-[(2-CARBOXY-ETHYLAMINO)-METHYL]-
BENZOIC ACID
C1FAV0.8
2004-CHLORO-L-PHENYLALANINEA,B2AKW0.76
0A9methyl L-phenylalaninateA1AY20.82
0A9methyl L-phenylalaninateI5ER10.82
0A9methyl L-phenylalaninateI,P1HDT0.82
3XH3-Hydroxyhippuric acidA3E9K0.71
1TY3-{(3E)-4-HYDROXY-6-OXO-3-[(2-PHENYLETHYL)IMINO]CYCLOHEXA-
1,4-DIEN-1-YL}ALANINE
A,B2CWU0.72
4FCA1YSG0.73
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.87
26CA,B2F7I0.72
186[1-(1-METHYL-4,5-DIOXO-PENT-2-ENYLCARBAMOYL)-
2-PHENYL-ETHYL]-CARBAMIC ACID BENZYL ESTER
X1U9Q0.71