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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02333973

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3HL(3S)-3-HYDROXYBUTANOIC ACIDA2ECQ0.72
3HL(3S)-3-HYDROXYBUTANOIC ACIDA,B,C,D3EEW0.72
3OH3-HYDROXY-PROPANOIC ACIDA1M330.72
SMB2-METHYLBUTANOIC ACIDA,B,C1YA80.73
SMB2-METHYLBUTANOIC ACIDA1UKA0.73
PIVPIVALIC ACIDB,D,F,H1SMR0.74
4PAPROPYL ACETATEA1TQH0.73
4PAPROPYL ACETATEA2O7R0.73
IVAISOVALERIC ACIDA1YOO0.73
IVAISOVALERIC ACIDE,I4ER20.73
IVAISOVALERIC ACIDE,I1APU0.73
IVAISOVALERIC ACIDE,I1APW0.73
IVAISOVALERIC ACIDE,I1APT0.73
IVAISOVALERIC ACIDA2D5Y0.73
IVAISOVALERIC ACIDA,I1GA40.73
IVAISOVALERIC ACIDE,I1PPK0.73
IVAISOVALERIC ACIDA,B,C,D1QS80.73
IVAISOVALERIC ACIDA,B,C1NLU0.73
IVAISOVALERIC ACIDA,B2RMP0.73
IVAISOVALERIC ACIDA,B1KE10.73
IVAISOVALERIC ACIDE,I1PPL0.73
IVAISOVALERIC ACIDA,B,C,D,I,J1LYB0.73
IVAISOVALERIC ACIDA2D640.73
IVAISOVALERIC ACIDI2ER00.73
IVAISOVALERIC ACIDI1QRP0.73
IVAISOVALERIC ACIDE,I1APV0.73
IVAISOVALERIC ACIDA,B1KDZ0.73
IVAISOVALERIC ACIDA1UK90.73
IVAISOVALERIC ACIDA,I1WKR0.73
IVAISOVALERIC ACIDA,I3FNT0.73
IVAISOVALERIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
3FV30.73
IVAISOVALERIC ACIDI1PSO0.73
IVAISOVALERIC ACIDI6APR0.73
IVAISOVALERIC ACIDA2D630.73
DXXMETHYLMALONIC ACIDA1CWZ0.71
DXXMETHYLMALONIC ACIDA,B,C,D,E,F1ON30.71
DXXMETHYLMALONIC ACIDA1CW80.71
IBU2-methylpropyl hydrogen carbonateA,B2K1Q0.72
EEEETHYL ACETATEA2QFL0.7
EEEETHYL ACETATEA,B,C1QFI0.7
EEEETHYL ACETATEA,B,C1YAH0.7
EEEETHYL ACETATEA,B,C1A7Y0.7
ALQ2-METHYL-PROPIONIC ACIDC,D1FKN0.8
ALQ2-METHYL-PROPIONIC ACIDC,D2ZHR0.8
ALQ2-METHYL-PROPIONIC ACIDA1IUP0.8
ALQ2-METHYL-PROPIONIC ACIDC,D1M4H0.8
ALQ2-METHYL-PROPIONIC ACIDA1R6N0.8
ALQ2-METHYL-PROPIONIC ACIDE,F,G,H1XN20.8
HIU(2R)-3-HYDROXY-2-METHYLPROPANOIC ACIDA3BPT0.88
RB3(1R)-3-{[(1R)-3-METHOXY-1-METHYL-
3-OXOPROPYL]OXY}-1-METHYL-3-OXOPROPYL (3R)-
3-HYDROXYBUTANOATE
A2D810.72
CA1ETHYL PROPIONATEB2B0F0.77