BDBM50537344 CHEMBL4540569

SMILES: Nc1n[nH]c2ccc(cc12)C(=O)Nc1ccccc1Cl

InChI Key: InChIKey=GQHZTWZYZYVKGA-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 = 50537344   

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
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50537344 (CHEMBL4540569) Show SMILES Nc1n[nH]c2ccc(cc12)C(=O)Nc1ccccc1Cl Show InChI InChI=1S/C14H11ClN4O/c15-10-3-1-2-4-12(10)17-14(20)8-5-6-11-9(7-8)13(16)19-18-11/h1-7H,(H,17,20)(H3,16,18,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of JAK2 (unknown origin) after 1 hr FRET-based Z'-Lyte assay				Bioorg Med Chem 27: 1497-1508 (2019) Article DOI: 10.1016/j.bmc.2019.02.029
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM50537344 (CHEMBL4540569) Show SMILES Nc1n[nH]c2ccc(cc12)C(=O)Nc1ccccc1Cl Show InChI InChI=1S/C14H11ClN4O/c15-10-3-1-2-4-12(10)17-14(20)8-5-6-11-9(7-8)13(16)19-18-11/h1-7H,(H,17,20)(H3,16,18,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.27E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of JAK1 (unknown origin) after 1 hr by FRET-based Z'-Lyte assay				Bioorg Med Chem 27: 1497-1508 (2019) Article DOI: 10.1016/j.bmc.2019.02.029
					More data for this Ligand-Target Pair