BDBM390027 4-amino-1-[1-[(E)-4- (dimethylamino)but-2- enoyl]azetidin-3-yl]-3-(4- phenoxyphenyl)-6H-pyrrolo[2,3- d]pyridazin-7-one::US10323037, Example 40::US9951077, 40

SMILES: CN(C)C\C=C\C(=O)N1CC(C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12

InChI Key: InChIKey=SEABALWQAAPSLH-RMKNXTFCSA-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 = 390027   

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))	BDBM390027 (4-amino-1-[1-[(E)-4- (dimethylamino)but-2- enoyl]a...) Show SMILES CN(C)C\C=C\C(=O)N1CC(C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C27H28N6O3/c1-31(2)14-6-9-23(34)32-15-19(16-32)33-17-22(24-25(33)27(35)30-29-26(24)28)18-10-12-21(13-11-18)36-20-7-4-3-5-8-20/h3-13,17,19H,14-16H2,1-2H3,(H2,28,29)(H,30,35)/b9-6+	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	505	n/a	n/a	n/a	n/a	n/a	n/a
JIANGSU HENGRUI MEDICINE CO., LTD. US Patent					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				US Patent US10323037 (2019) BindingDB Entry DOI: 10.7270/Q2W098BW
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM390027 (4-amino-1-[1-[(E)-4- (dimethylamino)but-2- enoyl]a...) Show SMILES CN(C)C\C=C\C(=O)N1CC(C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C27H28N6O3/c1-31(2)14-6-9-23(34)32-15-19(16-32)33-17-22(24-25(33)27(35)30-29-26(24)28)18-10-12-21(13-11-18)36-20-7-4-3-5-8-20/h3-13,17,19H,14-16H2,1-2H3,(H2,28,29)(H,30,35)/b9-6+	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	505	n/a	n/a	n/a	n/a	n/a	n/a
GSK					Assay Description The Btk kinase assay was performed using a ADP-Glo Btk kinase assay kit purchased from Promega (Madison, Wis.). The assay was conducted according to ...				Bioorg Med Chem Lett 17: 3972-7 (2007) BindingDB Entry DOI: 10.7270/Q2MG7RV0
					More data for this Ligand-Target Pair