BDBM316782 2-[(1-acryloylpiperidin-4-yl)amino]-N-cyclohexyl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide::US9617258, Example 278

SMILES: C=CC(=O)N1CCC(CC1)Nc1cnc2[nH]cc(C(=O)NC3CCCCC3)c2n1

InChI Key: InChIKey=LJPOYSBJZGZQBJ-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 4 hits for monomerid = 316782   

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 JAK3 (Homo sapiens (Human))	BDBM316782 (2-[(1-acryloylpiperidin-4-yl)amino]-N-cyclohexyl-5...) Show SMILES C=CC(=O)N1CCC(CC1)Nc1cnc2[nH]cc(C(=O)NC3CCCCC3)c2n1 Show InChI InChI=1S/C21H28N6O2/c1-2-18(28)27-10-8-15(9-11-27)24-17-13-23-20-19(26-17)16(12-22-20)21(29)25-14-6-4-3-5-7-14/h2,12-15H,1,3-11H2,(H,22,23)(H,24,26)(H,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. US Patent					Assay Description Test article was solubilized in dimethyl sulfoxide (DMSO) to a stock concentration of 30 mM. An 11-point half log dilution series was created in DMSO...				US Patent US9617258 (2017) BindingDB Entry DOI: 10.7270/Q2JD4ZWG
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM316782 (2-[(1-acryloylpiperidin-4-yl)amino]-N-cyclohexyl-5...) Show SMILES C=CC(=O)N1CCC(CC1)Nc1cnc2[nH]cc(C(=O)NC3CCCCC3)c2n1 Show InChI InChI=1S/C21H28N6O2/c1-2-18(28)27-10-8-15(9-11-27)24-17-13-23-20-19(26-17)16(12-22-20)21(29)25-14-6-4-3-5-7-14/h2,12-15H,1,3-11H2,(H,22,23)(H,24,26)(H,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	6.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM316782 (2-[(1-acryloylpiperidin-4-yl)amino]-N-cyclohexyl-5...) Show SMILES C=CC(=O)N1CCC(CC1)Nc1cnc2[nH]cc(C(=O)NC3CCCCC3)c2n1 Show InChI InChI=1S/C21H28N6O2/c1-2-18(28)27-10-8-15(9-11-27)24-17-13-23-20-19(26-17)16(12-22-20)21(29)25-14-6-4-3-5-7-14/h2,12-15H,1,3-11H2,(H,22,23)(H,24,26)(H,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM316782 (2-[(1-acryloylpiperidin-4-yl)amino]-N-cyclohexyl-5...) Show SMILES C=CC(=O)N1CCC(CC1)Nc1cnc2[nH]cc(C(=O)NC3CCCCC3)c2n1 Show InChI InChI=1S/C21H28N6O2/c1-2-18(28)27-10-8-15(9-11-27)24-17-13-23-20-19(26-17)16(12-22-20)21(29)25-14-6-4-3-5-7-14/h2,12-15H,1,3-11H2,(H,22,23)(H,24,26)(H,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.30	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. US Patent					Assay Description Test article was solubilized in dimethyl sulfoxide (DMSO) to a stock concentration of 30 mM. An 11-point half log dilution series was created in DMSO...				US Patent US9617258 (2017) BindingDB Entry DOI: 10.7270/Q2JD4ZWG
					More data for this Ligand-Target Pair