BDBM50133899 CHEMBL3734879

SMILES: Fc1cnc(Nc2cccc(c2)N2CCOCC2)nc1Nc1c(F)cccc1F

InChI Key: InChIKey=ZNQWJLREBSRVBU-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 = 50133899   

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
Cyclin-Dependent Kinase 9 (CDK9) (Homo sapiens (Human))	BDBM50133899 (CHEMBL3734879) Show SMILES Fc1cnc(Nc2cccc(c2)N2CCOCC2)nc1Nc1c(F)cccc1F Show InChI InChI=1S/C20H18F3N5O/c21-15-5-2-6-16(22)18(15)26-19-17(23)12-24-20(27-19)25-13-3-1-4-14(11-13)28-7-9-29-10-8-28/h1-6,11-12H,7-10H2,(H2,24,25,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Medical Sciences and Peking Union Medical College Curated by ChEMBL					Assay Description Inhibition of CDK9/Cyclin-T1 (unknown origin) using UlightCFFKNIVTPRTPPPSQGK-amide substrate after 90 mins by autoradiography				Medchemcomm 6: 444-454 (2015) BindingDB Entry DOI: 10.7270/Q2CJ8G9D
					More data for this Ligand-Target Pair
CDK2/CycE (Homo sapiens (Human))	BDBM50133899 (CHEMBL3734879) Show SMILES Fc1cnc(Nc2cccc(c2)N2CCOCC2)nc1Nc1c(F)cccc1F Show InChI InChI=1S/C20H18F3N5O/c21-15-5-2-6-16(22)18(15)26-19-17(23)12-24-20(27-19)25-13-3-1-4-14(11-13)28-7-9-29-10-8-28/h1-6,11-12H,7-10H2,(H2,24,25,26,27)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.85E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Medical Sciences and Peking Union Medical College Curated by ChEMBL					Assay Description Inhibition of CDK2/cyclin E1 (unknown origin) expressed in Sf9 insect cells using UlightCFFKNIVTPRTPPPSQGK-amide substrate after 15 mins by autoradio...				Medchemcomm 6: 444-454 (2015) BindingDB Entry DOI: 10.7270/Q2CJ8G9D
					More data for this Ligand-Target Pair