BDBM366448 4-[[8-[4- (cyanomethyl)-4- phenyl-1-piperidyl]- [1,2,4]triazolo[1,5- a]pyridin-2-yl]amino]- N-methyl-N-(1- methyl-4- piperidyl)benzamide::US9873709, Example 1-41

SMILES: CN(C1CCN(C)CC1)C(=O)c1ccc(Nc2nc3c(cccn3n2)N2CCC(CC#N)(CC2)c2ccccc2)cc1

InChI Key: InChIKey=AEYXDCFBNVYPGT-UHFFFAOYSA-N

Data: 2 KI

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 = 366448   

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))	BDBM366448 (4-[[8-[4- (cyanomethyl)-4- phenyl-1-piperidyl]- [1...) Show SMILES CN(C1CCN(C)CC1)C(=O)c1ccc(Nc2nc3c(cccn3n2)N2CCC(CC#N)(CC2)c2ccccc2)cc1 Show InChI InChI=1S/C33H38N8O/c1-38-21-14-28(15-22-38)39(2)31(42)25-10-12-27(13-11-25)35-32-36-30-29(9-6-20-41(30)37-32)40-23-17-33(16-19-34,18-24-40)26-7-4-3-5-8-26/h3-13,20,28H,14-18,21-24H2,1-2H3,(H,35,37)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University					Assay Description The activity of the isolated recombinant JAK1 and JAK2 kinase domain was measured by monitoring phosphorylation of a peptide derived from JAK3 (Val-A...				J Med Chem 51: 68-76 (2008) BindingDB Entry DOI: 10.7270/Q2CC130F
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Homo sapiens (Human))	BDBM366448 (4-[[8-[4- (cyanomethyl)-4- phenyl-1-piperidyl]- [1...) Show SMILES CN(C1CCN(C)CC1)C(=O)c1ccc(Nc2nc3c(cccn3n2)N2CCC(CC#N)(CC2)c2ccccc2)cc1 Show InChI InChI=1S/C33H38N8O/c1-38-21-14-28(15-22-38)39(2)31(42)25-10-12-27(13-11-25)35-32-36-30-29(9-6-20-41(30)37-32)40-23-17-33(16-19-34,18-24-40)26-7-4-3-5-8-26/h3-13,20,28H,14-18,21-24H2,1-2H3,(H,35,37)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.05	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University					Assay Description The activity of the isolated recombinant JAK1 and JAK2 kinase domain was measured by monitoring phosphorylation of a peptide derived from JAK3 (Val-A...				J Med Chem 51: 68-76 (2008) BindingDB Entry DOI: 10.7270/Q2CC130F
					More data for this Ligand-Target Pair