Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase BTK' and Ligand = 'BDBM397305'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM397305 (US10596172, Compound I-86 | US10828300, Compound I...) Show SMILES Fc1cnc(Nc2ccc(OCc3ccccn3)c(Cl)c2)nc1Nc1cccc(NC(=O)C=C)c1 Show InChI InChI=1S/C25H20ClFN6O2/c1-2-23(34)30-16-7-5-8-17(12-16)31-24-21(27)14-29-25(33-24)32-18-9-10-22(20(26)13-18)35-15-19-6-3-4-11-28-19/h2-14H,1,15H2,(H,30,34)(H2,29,31,32,33)	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
Celgene CAR LLC US Patent					Assay Description Briefly, 10× stocks of EGFR-WT (PV3872) from Invitrogen and EGFR-T790M/L858R (40350) from BPS Bioscience, San Diego, Calif., 1.13×ATP (AS001A) and ap...				US Patent US10596172 (2020) BindingDB Entry DOI: 10.7270/Q2VM4G9X
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM397305 (US10596172, Compound I-86 | US10828300, Compound I...) Show SMILES Fc1cnc(Nc2ccc(OCc3ccccn3)c(Cl)c2)nc1Nc1cccc(NC(=O)C=C)c1 Show InChI InChI=1S/C25H20ClFN6O2/c1-2-23(34)30-16-7-5-8-17(12-16)31-24-21(27)14-29-25(33-24)32-18-9-10-22(20(26)13-18)35-15-19-6-3-4-11-28-19/h2-14H,1,15H2,(H,30,34)(H2,29,31,32,33)	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
Celgene CAR LLC US Patent					Assay Description Briefly, 10× stocks of EGFR-WT (PV3872) from Invitrogen and EGFR-T790M/L858R (40350) from BPS Bioscience, San Diego, Calif., 1.13×ATP (AS001A) and ap...				US Patent US10828300 (2020) BindingDB Entry DOI: 10.7270/Q2JS9THK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM397305 (US10596172, Compound I-86 | US10828300, Compound I...) Show SMILES Fc1cnc(Nc2ccc(OCc3ccccn3)c(Cl)c2)nc1Nc1cccc(NC(=O)C=C)c1 Show InChI InChI=1S/C25H20ClFN6O2/c1-2-23(34)30-16-7-5-8-17(12-16)31-24-21(27)14-29-25(33-24)32-18-9-10-22(20(26)13-18)35-15-19-6-3-4-11-28-19/h2-14H,1,15H2,(H,30,34)(H2,29,31,32,33)	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	<100	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Briefly, 10x stocks of EGFR-WT (PV3872) from Invitrogen and EGFR-T790M/L858R (40350) from BPS Bioscience, San Diego, Calif., 1.13×ATP (AS001A) and ap...				Citation and Details BindingDB Entry DOI: 10.7270/Q2X92FHZ
					More data for this Ligand-Target Pair