BDBM303626 US10138229, Example 138::US10875852, Example 138

SMILES: CCCOc1ccc(cc1F)-c1nn(C2CC3(C2)CN(C3)C(=O)C#CC)c(N)c1C(N)=O

InChI Key: InChIKey=NPTJCYJZIDBMMO-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 = 303626   

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 BTK (Homo sapiens (Human))	BDBM303626 (US10138229, Example 138 | US10875852, Example 138) Show SMILES CCCOc1ccc(cc1F)-c1nn(C2CC3(C2)CN(C3)C(=O)C#CC)c(N)c1C(N)=O Show InChI InChI=1S/C23H26FN5O3/c1-3-5-18(30)28-12-23(13-28)10-15(11-23)29-21(25)19(22(26)31)20(27-29)14-6-7-17(16(24)9-14)32-8-4-2/h6-7,9,15H,4,8,10-13,25H2,1-2H3,(H2,26,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description An HTRF assay (Cisbio KinEASE-TK cat #62TK0PEC) was performed to quantitate the ability of test compounds to inhibit BTK mediated phosphorylation of ...				US Patent US10875852 (2020)
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM303626 (US10138229, Example 138 | US10875852, Example 138) Show SMILES CCCOc1ccc(cc1F)-c1nn(C2CC3(C2)CN(C3)C(=O)C#CC)c(N)c1C(N)=O Show InChI InChI=1S/C23H26FN5O3/c1-3-5-18(30)28-12-23(13-28)10-15(11-23)29-21(25)19(22(26)31)20(27-29)14-6-7-17(16(24)9-14)32-8-4-2/h6-7,9,15H,4,8,10-13,25H2,1-2H3,(H2,26,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description TBDAn HTRF assay (Cisbio KinEASE-TK cat #62TKOPEC) was performed to quantitate the ability of test compounds to inhibit BTK mediated phosphorylation ...				US Patent US10138229 (2018) BindingDB Entry DOI: 10.7270/Q2CJ8GJJ
					More data for this Ligand-Target Pair