BDBM317619 US10640491, Compound 8::US9624201, Compound 8::{5-Amino-1- [4-(2,3- difluoro- phenoxy)-2- methyl- phenyl]-1H- pyrazol-4-yl}- (4-pyridin-2- yl-1H-indol-2- yl)-methanone

SMILES: Cc1cc(Oc2cccc(F)c2F)ccc1-n1ncc(C(=O)c2cc3c(cccc3[nH]2)-c2ccccn2)c1N

InChI Key: InChIKey=YAIBJAVZDXUHCI-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 3 hits for monomerid = 317619   

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))	BDBM317619 (US10640491, Compound 8 | US11104668, Compound 8 | ...) Show SMILES Cc1cc(Oc2cccc(F)c2F)ccc1-n1ncc(C(=O)c2cc3c(cccc3[nH]2)-c2ccccn2)c1N Show InChI InChI=1S/C30H21F2N5O2/c1-17-14-18(39-27-10-5-7-22(31)28(27)32)11-12-26(17)37-30(33)21(16-35-37)29(38)25-15-20-19(6-4-9-24(20)36-25)23-8-2-3-13-34-23/h2-16,36H,33H2,1H3	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	6.15	n/a	n/a	n/a	n/a	n/a	n/a
HOFFMANN-LA ROCHE INC.; CHUGAI PHARMACEUTICAL CO. US Patent					Assay Description The assay is a capture of radioactive 33P phosphorylated product through filtration. The interactions of Btk, biotinylated SH2 peptide substrate (Src...				US Patent US9624201 (2017) BindingDB Entry DOI: 10.7270/Q2TQ63NB
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM317619 (US10640491, Compound 8 | US11104668, Compound 8 | ...) Show SMILES Cc1cc(Oc2cccc(F)c2F)ccc1-n1ncc(C(=O)c2cc3c(cccc3[nH]2)-c2ccccn2)c1N Show InChI InChI=1S/C30H21F2N5O2/c1-17-14-18(39-27-10-5-7-22(31)28(27)32)11-12-26(17)37-30(33)21(16-35-37)29(38)25-15-20-19(6-4-9-24(20)36-25)23-8-2-3-13-34-23/h2-16,36H,33H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	6.15	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 BTK (Homo sapiens (Human))	BDBM317619 (US10640491, Compound 8 | US11104668, Compound 8 | ...) Show SMILES Cc1cc(Oc2cccc(F)c2F)ccc1-n1ncc(C(=O)c2cc3c(cccc3[nH]2)-c2ccccn2)c1N Show InChI InChI=1S/C30H21F2N5O2/c1-17-14-18(39-27-10-5-7-22(31)28(27)32)11-12-26(17)37-30(33)21(16-35-37)29(38)25-15-20-19(6-4-9-24(20)36-25)23-8-2-3-13-34-23/h2-16,36H,33H2,1H3	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	6.15	n/a	n/a	n/a	n/a	n/a	n/a
HOFFMANN-LA ROCHE INC. US Patent					Assay Description This BTK competition assay measures compound potency (IC50) for the inactivated state of Bruton's Tyrosine Kinase using FRET (Förster/Flouresence...				US Patent US10640491 (2020)
					More data for this Ligand-Target Pair