BDBM14671 Fragment 1::Phosphate::phosphoric acid

SMILES: OP(O)(O)=O

InChI Key: InChIKey=NBIIXXVUZAFLBC-UHFFFAOYSA-N

Data: 4 KI  1 IC50

PDB links: 1313 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 14671   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Ornithine carbamoyltransferase (Homo sapiens (Human))	BDBM14671 (Fragment 1 | Phosphate | phosphoric acid) Show SMILES OP(O)(O)=O Show InChI InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	6.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	8.0	n/a
Universit£tstrasse 16 Curated by ChEMBL					Assay Description Binding affinity against ornithine transcarbamoylase (OTC) produced by Streptococcus faecalis The buffer taken for this study is 50 mM Tris.HCl, 0.5 ...				J Med Chem 42: 2633-40 (1999) Article DOI: 10.1021/jm991008q BindingDB Entry DOI: 10.7270/Q2NV9JX8
					More data for this Ligand-Target Pair
Ornithine carbamoyltransferase (Homo sapiens (Human))	BDBM14671 (Fragment 1 | Phosphate | phosphoric acid) Show SMILES OP(O)(O)=O Show InChI InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.20E+7	n/a	n/a	n/a	n/a	n/a	n/a	7.0	n/a
Universit£tstrasse 16 Curated by ChEMBL					Assay Description Binding affinity against ornithine transcarbamoylase (OTC) produced by Streptococcus faecalis The buffer taken for this study is 50 mM Tris.HCl, 0.5 ...				J Med Chem 42: 2633-40 (1999) Article DOI: 10.1021/jm991008q BindingDB Entry DOI: 10.7270/Q2NV9JX8
					More data for this Ligand-Target Pair
Ornithine carbamoyltransferase (Homo sapiens (Human))	BDBM14671 (Fragment 1 | Phosphate | phosphoric acid) Show SMILES OP(O)(O)=O Show InChI InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	>2.00E+7	n/a	n/a	n/a	n/a	n/a	n/a	6.0	n/a
Universit£tstrasse 16 Curated by ChEMBL					Assay Description Binding affinity against ornithine transcarbamoylase (OTC) produced by Streptococcus faecalis The buffer taken for this study is 50 mM maleate, 0.5 m...				J Med Chem 42: 2633-40 (1999) Article DOI: 10.1021/jm991008q BindingDB Entry DOI: 10.7270/Q2NV9JX8
					More data for this Ligand-Target Pair
Ketopantoate reductase (Escherichia coli (strain K12))	BDBM14671 (Fragment 1 | Phosphate | phosphoric acid) Show SMILES OP(O)(O)=O Show InChI InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	2.70E+7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University Chemical Laboratory Curated by ChEMBL					Assay Description Inhibition of Escherichia coli KPR				J Med Chem 49: 4992-5000 (2006) Article DOI: 10.1021/jm060490r BindingDB Entry DOI: 10.7270/Q28S4QQN
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (aa 145-252) (Homo sapiens (Human))	BDBM14671 (Fragment 1 | Phosphate | phosphoric acid) Show SMILES OP(O)(O)=O Show InChI InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)	PDB MMDB B.MOAD DrugBank GoogleScholar AffyNet	Purchase MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	>4.00E+7	n/a	n/a	n/a	n/a	7.4	22
Aventis Pharma					Assay Description SPA uses 125I as energy donor and scintillant-coated beads as energy acceptor. The labeled ligand is captured by the biotinylated Src-SH2 protein imm...				J Med Chem 46: 5184-95 (2003) Article DOI: 10.1021/jm020970s BindingDB Entry DOI: 10.7270/Q2XW4H14
					More data for this Ligand-Target Pair				3D Structure (crystal)