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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02345470

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PIVPIVALIC ACIDB,D,F,H1SMR0.72
MLAMALONIC ACIDA,B1OBL0.77
MLAMALONIC ACIDA,B,C,D2FAH0.77
MLAMALONIC ACIDA,B1PQH0.77
MLAMALONIC ACIDA1O4M0.77
MLAMALONIC ACIDA2APW0.77
MLAMALONIC ACIDA1S7F0.77
MLAMALONIC ACIDT,U,X,Y1E7P0.77
MLAMALONIC ACIDA,B1RD50.77
MLAMALONIC ACIDA,B1NU40.77
MLAMALONIC ACIDA2APB0.77
MLAMALONIC ACIDA3EIF0.77
MLAMALONIC ACIDA,B,C,D2ID40.77
MLAMALONIC ACIDB2VLN0.77
MLAMALONIC ACIDA,B3BF80.77
MLAMALONIC ACIDA2G2Z0.77
MLAMALONIC ACIDB2APT0.77
MLAMALONIC ACIDA2APV0.77
MLAMALONIC ACIDA2APF0.77
MLAMALONIC ACIDA2FW00.77
MLAMALONIC ACIDA1Q440.77
MLAMALONIC ACIDB2VLP0.77
MLAMALONIC ACIDA1S1F0.77
MLAMALONIC ACIDA,B1WOM0.77
MLAMALONIC ACIDX2BRV0.77
MLAMALONIC ACIDA,B,C,D2ZBB0.77
MLAMALONIC ACIDA,B,D1T0F0.77
MLAMALONIC ACIDA2Q3M0.77
MLAMALONIC ACIDB2VLQ0.77
MLAMALONIC ACIDA,B1YS40.77
MLAMALONIC ACIDA,B3E4P0.77
MLAMALONIC ACIDA3CZA0.77
MLAMALONIC ACIDA,B3H090.77
MLAMALONIC ACIDB,D,F,H,J,L1S0Y0.77
MLAMALONIC ACIDA,B2F8A0.77
MLAMALONIC ACIDA2WAL0.77
MLAMALONIC ACIDA,B1O9P0.77
MLAMALONIC ACIDA,B,C,D,E,F,H2QAD0.77
MLAMALONIC ACIDA,B1OCL0.77
MLAMALONIC ACIDA2APX0.77
HIU(2R)-3-HYDROXY-2-METHYLPROPANOIC ACIDA3BPT0.85
3HL(3S)-3-HYDROXYBUTANOIC ACIDA2ECQ0.7
3HL(3S)-3-HYDROXYBUTANOIC ACIDA,B,C,D3EEW0.7
ALQ2-METHYL-PROPIONIC ACIDC,D1FKN0.77
ALQ2-METHYL-PROPIONIC ACIDC,D2ZHR0.77
ALQ2-METHYL-PROPIONIC ACIDA1IUP0.77
ALQ2-METHYL-PROPIONIC ACIDC,D1M4H0.77
ALQ2-METHYL-PROPIONIC ACIDA1R6N0.77
ALQ2-METHYL-PROPIONIC ACIDE,F,G,H1XN20.77
LMLISOBUTYL MALONIC ACIDA1BFW0.76
SMB2-METHYLBUTANOIC ACIDA,B,C1YA80.71
SMB2-METHYLBUTANOIC ACIDA1UKA0.71
IVAISOVALERIC ACIDA1YOO0.71
IVAISOVALERIC ACIDE,I4ER20.71
IVAISOVALERIC ACIDE,I1APU0.71
IVAISOVALERIC ACIDE,I1APW0.71
IVAISOVALERIC ACIDE,I1APT0.71
IVAISOVALERIC ACIDA2D5Y0.71
IVAISOVALERIC ACIDA,I1GA40.71
IVAISOVALERIC ACIDE,I1PPK0.71
IVAISOVALERIC ACIDA,B,C,D1QS80.71
IVAISOVALERIC ACIDA,B,C1NLU0.71
IVAISOVALERIC ACIDA,B2RMP0.71
IVAISOVALERIC ACIDA,B1KE10.71
IVAISOVALERIC ACIDE,I1PPL0.71
IVAISOVALERIC ACIDA,B,C,D,I,J1LYB0.71
IVAISOVALERIC ACIDA2D640.71
IVAISOVALERIC ACIDI2ER00.71
IVAISOVALERIC ACIDI1QRP0.71
IVAISOVALERIC ACIDE,I1APV0.71
IVAISOVALERIC ACIDA,B1KDZ0.71
IVAISOVALERIC ACIDA1UK90.71
IVAISOVALERIC ACIDA,I1WKR0.71
IVAISOVALERIC ACIDA,I3FNT0.71
IVAISOVALERIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
3FV30.71
IVAISOVALERIC ACIDI1PSO0.71
IVAISOVALERIC ACIDI6APR0.71
IVAISOVALERIC ACIDA2D630.71
RB3(1R)-3-{[(1R)-3-METHOXY-1-METHYL-
3-OXOPROPYL]OXY}-1-METHYL-3-OXOPROPYL (3R)-
3-HYDROXYBUTANOATE
A2D810.7
DXXMETHYLMALONIC ACIDA1CWZ0.9
DXXMETHYLMALONIC ACIDA,B,C,D,E,F1ON30.9
DXXMETHYLMALONIC ACIDA1CW80.9