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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00023157

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DHJ4-(2-CARBOXYETHYL)(HYDROXY)PHOSPHORYL]-
3-OXOBUTANOIC ACID
A,B2HZY0.84
HBU4-[HYDROXY-[METHYL-PHOSPHINOYL]]-
3-OXO-BUTANOIC ACID
A,B1HYO0.82
BHX(2S)-2-{[(S)-(2-carboxyethyl)(hydroxy)phosphoryl]methyl}pentanedioic acidA3BHX0.7
PPRPHOSPHONOPYRUVATEA1KC70.77
PPRPHOSPHONOPYRUVATEA2HJP0.77
3PB(3R)-3-(phosphonooxy)butanoic acidA,B,C,D,E,F3FG80.73
G88(2S)-2-(PHOSPHONOMETHYL)PENTANEDIOIC ACIDA2JBJ0.76
G88(2S)-2-(PHOSPHONOMETHYL)PENTANEDIOIC ACIDA2PVW0.76
PEZ2-(PHOSPHONOOXY)BUTANOIC ACIDA,B1PCK0.71
3PP3-PHOSPHONOPROPANOIC ACIDA2RKD0.87
3PP3-PHOSPHONOPROPANOIC ACIDB1IIG0.87
3PP3-PHOSPHONOPROPANOIC ACIDA,B,C,D,E,F,
G,H
1HG30.87
TCEA,B3FO50.76
PAEPHOSPHONOACETIC ACIDA,B1EW80.77
PAEPHOSPHONOACETIC ACID0,1,3,4,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z
1VQ70.77
BUABUTANOIC ACIDA2CZ00.72
BUABUTANOIC ACIDA1P0I0.72
BUABUTANOIC ACIDA,B2HA70.72
BUABUTANOIC ACIDA1UK70.72
BUABUTANOIC ACIDA2J4C0.72
BUABUTANOIC ACIDA1ZRM0.72
BUABUTANOIC ACIDA3DLT0.72
BUABUTANOIC ACIDA1UGP0.72
BUABUTANOIC ACIDA,B2CZ10.72
KPA2-OXO-5-PHOSPHONOPENTANOIC ACIDA1VB30.82