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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02860042

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MEV(R)-MEVALONATEA,B1QAY0.75
MEV(R)-MEVALONATEA2HFU0.75
MEV(R)-MEVALONATEA,B1R310.75
MAH3-HYDROXY-3-METHYL-GLUTARIC ACIDA,B,C,D1DQA0.79
MAH3-HYDROXY-3-METHYL-GLUTARIC ACIDA,B,C,D1DQ80.79
LMLISOBUTYL MALONIC ACIDA1BFW0.8
3HL(3S)-3-HYDROXYBUTANOIC ACIDA2ECQ0.7
3HL(3S)-3-HYDROXYBUTANOIC ACIDA,B,C,D3EEW0.7
SMB2-METHYLBUTANOIC ACIDA,B,C1YA80.75
SMB2-METHYLBUTANOIC ACIDA1UKA0.75
IVAISOVALERIC ACIDA1YOO0.75
IVAISOVALERIC ACIDE,I4ER20.75
IVAISOVALERIC ACIDE,I1APU0.75
IVAISOVALERIC ACIDE,I1APW0.75
IVAISOVALERIC ACIDE,I1APT0.75
IVAISOVALERIC ACIDA2D5Y0.75
IVAISOVALERIC ACIDA,I1GA40.75
IVAISOVALERIC ACIDE,I1PPK0.75
IVAISOVALERIC ACIDA,B,C,D1QS80.75
IVAISOVALERIC ACIDA,B,C1NLU0.75
IVAISOVALERIC ACIDA,B2RMP0.75
IVAISOVALERIC ACIDA,B1KE10.75
IVAISOVALERIC ACIDE,I1PPL0.75
IVAISOVALERIC ACIDA,B,C,D,I,J1LYB0.75
IVAISOVALERIC ACIDA2D640.75
IVAISOVALERIC ACIDI2ER00.75
IVAISOVALERIC ACIDI1QRP0.75
IVAISOVALERIC ACIDE,I1APV0.75
IVAISOVALERIC ACIDA,B1KDZ0.75
IVAISOVALERIC ACIDA1UK90.75
IVAISOVALERIC ACIDA,I1WKR0.75
IVAISOVALERIC ACIDA,I3FNT0.75
IVAISOVALERIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
3FV30.75
IVAISOVALERIC ACIDI1PSO0.75
IVAISOVALERIC ACIDI6APR0.75
IVAISOVALERIC ACIDA2D630.75
2PP2-PROPYL-PENTANOIC ACIDP1DIT0.71
IPM3-ISOPROPYLMALIC ACIDA,B1A050.7
IPM3-ISOPROPYLMALIC ACIDA1HJ60.7
MICALPHA-METHYLISOCITRIC ACIDA1AMI0.73
4MV4-METHYL VALERIC ACIDA,B,C1I1M0.76
4MV4-METHYL VALERIC ACIDA,B,C2EIY0.76
4MV4-METHYL VALERIC ACIDA2ECO0.76
4MV4-METHYL VALERIC ACIDA,C,D1UMC0.76
4MV4-METHYL VALERIC ACIDA,B2COG0.76
KIV3-METHYL-2-OXOBUTANOIC ACIDA,B1KTA0.72
KIV3-METHYL-2-OXOBUTANOIC ACIDA1HJG0.72
KIV3-METHYL-2-OXOBUTANOIC ACIDA,B1SR90.72
KIV3-METHYL-2-OXOBUTANOIC ACIDA,B,C,D,E1O680.72
COI2-OXO-4-METHYLPENTANOIC ACIDA,B1QS00.73
COI2-OXO-4-METHYLPENTANOIC ACIDA,C1UMD0.73
COI2-OXO-4-METHYLPENTANOIC ACIDA1DXY0.73
COI2-OXO-4-METHYLPENTANOIC ACIDA,B2HDK0.73
COI2-OXO-4-METHYLPENTANOIC ACIDA1HJF0.73
DMV2,3-DIHYDROXY-VALERIANIC ACIDA,B,C,D1QMG0.7