BDBM50440148 CHEMBL2426561

SMILES: CCCc1sc(nc1CSc1nc(N)cc(N)n1)-c1cccc(F)c1

InChI Key: InChIKey=NAYQDORSLYPJGM-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 50440148   

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
Deoxycytidine kinase (Homo sapiens (Human))	BDBM50440148 (CHEMBL2426561) Show SMILES CCCc1sc(nc1CSc1nc(N)cc(N)n1)-c1cccc(F)c1 Show InChI InChI=1S/C17H18FN5S2/c1-2-4-13-12(9-24-17-22-14(19)8-15(20)23-17)21-16(25-13)10-5-3-6-11(18)7-10/h3,5-8H,2,4,9H2,1H3,(H4,19,20,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
California NanoSystems Institute Curated by ChEMBL					Assay Description Inhibition of dCK in human CCRF-CEM cells assessed as inhibition of tritiated deoxycytidine [3H]-dC uptake				J Med Chem 56: 6696-708 (2013) Article DOI: 10.1021/jm400457y BindingDB Entry DOI: 10.7270/Q2JS9RWP
					More data for this Ligand-Target Pair
Deoxycytidine kinase (Mus musculus)	BDBM50440148 (CHEMBL2426561) Show SMILES CCCc1sc(nc1CSc1nc(N)cc(N)n1)-c1cccc(F)c1 Show InChI InChI=1S/C17H18FN5S2/c1-2-4-13-12(9-24-17-22-14(19)8-15(20)23-17)21-16(25-13)10-5-3-6-11(18)7-10/h3,5-8H,2,4,9H2,1H3,(H4,19,20,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	175	n/a	n/a	n/a	n/a	n/a	n/a
California NanoSystems Institute Curated by ChEMBL					Assay Description Inhibition of dCK in mouse L1210 cells assessed as inhibition of tritiated deoxycytidine [3H]-dC uptake				J Med Chem 56: 6696-708 (2013) Article DOI: 10.1021/jm400457y BindingDB Entry DOI: 10.7270/Q2JS9RWP
					More data for this Ligand-Target Pair