BDBM50230317 CHEMBL4091022

SMILES: CSc1nc(NCc2ccccc2)c2ccn(Cc3ccc(F)cc3)c2n1

InChI Key: InChIKey=RENHBYHXMSFCBW-UHFFFAOYSA-N

Data: 1 KI  3 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 4 hits for monomerid = 50230317   

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
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50230317 (CHEMBL4091022) Show SMILES CSc1nc(NCc2ccccc2)c2ccn(Cc3ccc(F)cc3)c2n1 Show InChI InChI=1S/C21H19FN4S/c1-27-21-24-19(23-13-15-5-3-2-4-6-15)18-11-12-26(20(18)25-21)14-16-7-9-17(22)10-8-16/h2-12H,13-14H2,1H3,(H,23,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Genova Curated by ChEMBL					Assay Description Inhibition of human recombinant full length N-terminal His6-tagged Src expressed in Sf21 cells using KVEKIGEGTYGVVYK as substrate after 10 mins in pr...				Eur J Med Chem 127: 369-378 (2017) BindingDB Entry DOI: 10.7270/Q2959KTB
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50230317 (CHEMBL4091022) Show SMILES CSc1nc(NCc2ccccc2)c2ccn(Cc3ccc(F)cc3)c2n1 Show InChI InChI=1S/C21H19FN4S/c1-27-21-24-19(23-13-15-5-3-2-4-6-15)18-11-12-26(20(18)25-21)14-16-7-9-17(22)10-8-16/h2-12H,13-14H2,1H3,(H,23,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Genova Curated by ChEMBL					Assay Description Inhibition of Flt3 (unknown origin) using KVEKIGEGTYGVVYK as substrate after 10 mins in presence of [gamma-33P]ATP by scintillation counting method				Eur J Med Chem 127: 369-378 (2017) BindingDB Entry DOI: 10.7270/Q2959KTB
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Fyn (Homo sapiens (Human))	BDBM50230317 (CHEMBL4091022) Show SMILES CSc1nc(NCc2ccccc2)c2ccn(Cc3ccc(F)cc3)c2n1 Show InChI InChI=1S/C21H19FN4S/c1-27-21-24-19(23-13-15-5-3-2-4-6-15)18-11-12-26(20(18)25-21)14-16-7-9-17(22)10-8-16/h2-12H,13-14H2,1H3,(H,23,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.32E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Genova Curated by ChEMBL					Assay Description Inhibition of human recombinant full length N-terminal His6-tagged Fyn expressed in baculovirus infected Sf21 cells using KVEKIGEGTYGVVYK as substrat...				Eur J Med Chem 127: 369-378 (2017) BindingDB Entry DOI: 10.7270/Q2959KTB
					More data for this Ligand-Target Pair
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50230317 (CHEMBL4091022) Show SMILES CSc1nc(NCc2ccccc2)c2ccn(Cc3ccc(F)cc3)c2n1 Show InChI InChI=1S/C21H19FN4S/c1-27-21-24-19(23-13-15-5-3-2-4-6-15)18-11-12-26(20(18)25-21)14-16-7-9-17(22)10-8-16/h2-12H,13-14H2,1H3,(H,23,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Genova Curated by ChEMBL					Assay Description Inhibition of Abl (unknown origin)				Eur J Med Chem 127: 369-378 (2017) BindingDB Entry DOI: 10.7270/Q2959KTB
					More data for this Ligand-Target Pair