BDBM50291549 CHEMBL8265::Phosphocreatine analogue

SMILES: [O-]C(=O)CNC(=[NH2+])CP([O-])([O-])=O

InChI Key: InChIKey=PJTLWMQGQOBZDB-UHFFFAOYSA-L

Data: 1 KI

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 1 hit for monomerid = 50291549   

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
Creatine kinase M (Homo sapiens (Human))	BDBM50291549 (CHEMBL8265 | Phosphocreatine analogue) Show SMILES [O-]C(=O)CNC(=[NH2+])CP([O-])([O-])=O Show InChI InChI=1S/C4H9N2O5P/c5-3(2-12(9,10)11)6-1-4(7)8/h1-2H2,(H2,5,6)(H,7,8)(H2,9,10,11)/p-2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	5.70E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition against Creatine kinase(CK)				Bioorg Med Chem Lett 7: 1021-1026 (1997) Article DOI: 10.1016/S0960-894X(97)00161-3 BindingDB Entry DOI: 10.7270/Q2WW7HPG
					More data for this Ligand-Target Pair