BDBM50261773 CHEMBL4092337

SMILES: NC(=O)c1cnn2cccc2c1NCc1cccc(NC(=O)C=C)c1

InChI Key: InChIKey=JTIFCACVBIMKLW-UHFFFAOYSA-N

Data: 4 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 = 50261773   

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 JAK1 (Homo sapiens (Human))	BDBM50261773 (CHEMBL4092337) Show SMILES NC(=O)c1cnn2cccc2c1NCc1cccc(NC(=O)C=C)c1 Show InChI InChI=1S/C18H17N5O2/c1-2-16(24)22-13-6-3-5-12(9-13)10-20-17-14(18(19)25)11-21-23-8-4-7-15(17)23/h2-9,11,20H,1,10H2,(H2,19,25)(H,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development, Princeton, NJ 08543-4000, USA. Electronic address: james.kempson@bms.com. Curated by ChEMBL					Assay Description Inhibition of GST-tagged JAK1 (unknown origin) using fluoresceinated peptide as substrate after 3 hrs by caliper assay				Bioorg Med Chem Lett 27: 4622-4625 (2017) Article DOI: 10.1016/j.bmcl.2017.09.023 BindingDB Entry DOI: 10.7270/Q2X069HQ
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Homo sapiens (Human))	BDBM50261773 (CHEMBL4092337) Show SMILES NC(=O)c1cnn2cccc2c1NCc1cccc(NC(=O)C=C)c1 Show InChI InChI=1S/C18H17N5O2/c1-2-16(24)22-13-6-3-5-12(9-13)10-20-17-14(18(19)25)11-21-23-8-4-7-15(17)23/h2-9,11,20H,1,10H2,(H2,19,25)(H,22,24)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development, Princeton, NJ 08543-4000, USA. Electronic address: james.kempson@bms.com. Curated by ChEMBL					Assay Description Inhibition of His-tagged TYK2 (unknown origin) using fluoresceinated peptide as substrate after 3 hrs by caliper assay				Bioorg Med Chem Lett 27: 4622-4625 (2017) Article DOI: 10.1016/j.bmcl.2017.09.023 BindingDB Entry DOI: 10.7270/Q2X069HQ
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM50261773 (CHEMBL4092337) Show SMILES NC(=O)c1cnn2cccc2c1NCc1cccc(NC(=O)C=C)c1 Show InChI InChI=1S/C18H17N5O2/c1-2-16(24)22-13-6-3-5-12(9-13)10-20-17-14(18(19)25)11-21-23-8-4-7-15(17)23/h2-9,11,20H,1,10H2,(H2,19,25)(H,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development, Princeton, NJ 08543-4000, USA. Electronic address: james.kempson@bms.com. Curated by ChEMBL					Assay Description Inhibition of JAK3 (unknown origin) using CSKtide as substrate after 30 mins in presence of [gamma32P]ATP by top-count liquid scintillation counting ...				Bioorg Med Chem Lett 27: 4622-4625 (2017) Article DOI: 10.1016/j.bmcl.2017.09.023 BindingDB Entry DOI: 10.7270/Q2X069HQ
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50261773 (CHEMBL4092337) Show SMILES NC(=O)c1cnn2cccc2c1NCc1cccc(NC(=O)C=C)c1 Show InChI InChI=1S/C18H17N5O2/c1-2-16(24)22-13-6-3-5-12(9-13)10-20-17-14(18(19)25)11-21-23-8-4-7-15(17)23/h2-9,11,20H,1,10H2,(H2,19,25)(H,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development, Princeton, NJ 08543-4000, USA. Electronic address: james.kempson@bms.com. Curated by ChEMBL					Assay Description Inhibition of GST-tagged JAK2 (unknown origin) using fluoresceinated peptide as substrate after 3 hrs by caliper assay				Bioorg Med Chem Lett 27: 4622-4625 (2017) Article DOI: 10.1016/j.bmcl.2017.09.023 BindingDB Entry DOI: 10.7270/Q2X069HQ
					More data for this Ligand-Target Pair