BDBM155562 US9012461, 38

SMILES: CCN1CCC(CC1)c1ccc(Nc2ncc(c(CCc3ncccc3CC(N)=O)n2)C(F)(F)F)cc1

InChI Key: InChIKey=ZXHNNZHGIGUVEH-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 = 155562   

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
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM155562 (US9012461, 38) Show SMILES CCN1CCC(CC1)c1ccc(Nc2ncc(c(CCc3ncccc3CC(N)=O)n2)C(F)(F)F)cc1 Show InChI InChI=1S/C27H31F3N6O/c1-2-36-14-11-19(12-15-36)18-5-7-21(8-6-18)34-26-33-17-22(27(28,29)30)24(35-26)10-9-23-20(16-25(31)37)4-3-13-32-23/h3-8,13,17,19H,2,9-12,14-16H2,1H3,(H2,31,37)(H,33,34,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	23	n/a	n/a	n/a	n/a	7.0	n/a
Cancer Therapeutics CRC Pty Ltd US Patent					Assay Description Compounds of the invention may be tested for in vitro activity in the following assay: A biotin labeled peptide is used as substrate (amino acid sequ...				US Patent US9012461 (2015) BindingDB Entry DOI: 10.7270/Q2RN36K7
					More data for this Ligand-Target Pair
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM155562 (US9012461, 38) Show SMILES CCN1CCC(CC1)c1ccc(Nc2ncc(c(CCc3ncccc3CC(N)=O)n2)C(F)(F)F)cc1 Show InChI InChI=1S/C27H31F3N6O/c1-2-36-14-11-19(12-15-36)18-5-7-21(8-6-18)34-26-33-17-22(27(28,29)30)24(35-26)10-9-23-20(16-25(31)37)4-3-13-32-23/h3-8,13,17,19H,2,9-12,14-16H2,1H3,(H2,31,37)(H,33,34,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	23	n/a	n/a	n/a	n/a	7.4	n/a
Cancer Therapeutics CRC Pty Ltd US Patent					Assay Description A biotin labeled peptide is used as substrate (amino acid sequence: Biotin-Glu-Gly-Pro-Trp-Leu-Glu-Glu-Glu-Glu-Glu-Ala-Tyr-Gly-Trp-Met-Asp-Phe-NH2)1S...				US Patent US9012461 (2015) BindingDB Entry DOI: 10.7270/Q2RN36K7
					More data for this Ligand-Target Pair