BDBM390013 4-amino-1-[(3R)-1-[(E)-4- (diethylamino)but-2-enoyl]-3- piperidyl]-3-(4-phenoxyphenyl)-6H- pyrrolo[2,3-d]pyridazin-7-one::US10323037, Example 27::US9951077, 27

SMILES: CCN(CC)C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12

InChI Key: InChIKey=KBOOVHKVKXALAQ-LEBWJFOGSA-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 = 390013   

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))	BDBM390013 (4-amino-1-[(3R)-1-[(E)-4- (diethylamino)but-2-enoy...) Show SMILES CCN(CC)C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C31H36N6O3/c1-3-35(4-2)18-9-13-27(38)36-19-8-10-23(20-36)37-21-26(28-29(37)31(39)34-33-30(28)32)22-14-16-25(17-15-22)40-24-11-6-5-7-12-24/h5-7,9,11-17,21,23H,3-4,8,10,18-20H2,1-2H3,(H2,32,33)(H,34,39)/b13-9+/t23-/m1/s1	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	<10	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))	BDBM390013 (4-amino-1-[(3R)-1-[(E)-4- (diethylamino)but-2-enoy...) Show SMILES CCN(CC)C\C=C\C(=O)N1CCC[C@H](C1)n1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)n[nH]c(=O)c12 Show InChI InChI=1S/C31H36N6O3/c1-3-35(4-2)18-9-13-27(38)36-19-8-10-23(20-36)37-21-26(28-29(37)31(39)34-33-30(28)32)22-14-16-25(17-15-22)40-24-11-6-5-7-12-24/h5-7,9,11-17,21,23H,3-4,8,10,18-20H2,1-2H3,(H2,32,33)(H,34,39)/b13-9+/t23-/m1/s1	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	<10	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