BDBM50402997 CHEMBL2207429

SMILES: CN(CCc1ccccn1)C(=O)c1cc2cccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c2[nH]1

InChI Key: InChIKey=AASJEUHBEWXQIG-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50402997   

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
Protein-tyrosine kinase 2-beta (Mus musculus)	BDBM50402997 (CHEMBL2207429) Show SMILES CN(CCc1ccccn1)C(=O)c1cc2cccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c2[nH]1 Show InChI InChI=1S/C32H35N7O2/c1-21-12-14-24(15-13-21)39-28(20-27(37-39)32(2,3)4)36-31(41)35-25-11-8-9-22-19-26(34-29(22)25)30(40)38(5)18-16-23-10-6-7-17-33-23/h6-15,17,19-20,34H,16,18H2,1-5H3,(H2,35,36,41)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	553	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of PYK2 in mouse NIH-3T3 cells by LI-COR assay				Bioorg Med Chem Lett 22: 7523-9 (2012) Article DOI: 10.1016/j.bmcl.2012.10.039 BindingDB Entry DOI: 10.7270/Q2319X2C
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM50402997 (CHEMBL2207429) Show SMILES CN(CCc1ccccn1)C(=O)c1cc2cccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c2[nH]1 Show InChI InChI=1S/C32H35N7O2/c1-21-12-14-24(15-13-21)39-28(20-27(37-39)32(2,3)4)36-31(41)35-25-11-8-9-22-19-26(34-29(22)25)30(40)38(5)18-16-23-10-6-7-17-33-23/h6-15,17,19-20,34H,16,18H2,1-5H3,(H2,35,36,41)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of FAK after 2hrs by fluorescence polarization assay				Bioorg Med Chem Lett 22: 7523-9 (2012) Article DOI: 10.1016/j.bmcl.2012.10.039 BindingDB Entry DOI: 10.7270/Q2319X2C
					More data for this Ligand-Target Pair
PTK2B protein tyrosine kinase 2 beta (PTK2B) (Homo sapiens (Human))	BDBM50402997 (CHEMBL2207429) Show SMILES CN(CCc1ccccn1)C(=O)c1cc2cccc(NC(=O)Nc3cc(nn3-c3ccc(C)cc3)C(C)(C)C)c2[nH]1 Show InChI InChI=1S/C32H35N7O2/c1-21-12-14-24(15-13-21)39-28(20-27(37-39)32(2,3)4)36-31(41)35-25-11-8-9-22-19-26(34-29(22)25)30(40)38(5)18-16-23-10-6-7-17-33-23/h6-15,17,19-20,34H,16,18H2,1-5H3,(H2,35,36,41)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	398	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His-tagged PYK2 using ATP as substrate incubated for 1 hr prior to substrate addition				Bioorg Med Chem Lett 22: 7523-9 (2012) Article DOI: 10.1016/j.bmcl.2012.10.039 BindingDB Entry DOI: 10.7270/Q2319X2C
					More data for this Ligand-Target Pair