Compile Data Set for Download or QSAR

Found 14 hits with Last Name = 'treambleau' and Initial = 'l'   

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
Serine/threonine-protein kinase B-raf (Mus musculus)	BDBM5446 (CHEMBL553 | ERLOTINIB HYDROCHLORIDE | Erlotinib | ...) Show SMILES COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC Show InChI InChI=1S/C22H23N3O4/c1-4-16-6-5-7-17(12-16)25-22-18-13-20(28-10-8-26-2)21(29-11-9-27-3)14-19(18)23-15-24-22/h1,5-7,12-15H,8-11H2,2-3H3,(H,23,24,25)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of mouse full-length GST-tagged BRAF V600E mutant using recombinant human full length N-terminal His-tagged MEK1 as substrate preincubated...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM5446 (CHEMBL553 | ERLOTINIB HYDROCHLORIDE | Erlotinib | ...) Show SMILES COCCOc1cc2ncnc(Nc3cccc(c3)C#C)c2cc1OCCOC Show InChI InChI=1S/C22H23N3O4/c1-4-16-6-5-7-17(12-16)25-22-18-13-20(28-10-8-26-2)21(29-11-9-27-3)14-19(18)23-15-24-22/h1,5-7,12-15H,8-11H2,2-3H3,(H,23,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank MMDB PDB Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of His6-tagged EGFR (unknown origin) cytoplasmic domain expressed in baculovirus infected Sf9 insect cells after 10 mins followed by addit...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair				3D Structure (crystal)
Serine/threonine-protein kinase B-raf (Mus musculus)	BDBM50457924 (CHEMBL4208224) Show SMILES Cc1c2cc(Cl)ccc2n2cc(Cc3ccccc3)[nH]c(=O)c12 Show InChI InChI=1S/C19H15ClN2O/c1-12-16-10-14(20)7-8-17(16)22-11-15(21-19(23)18(12)22)9-13-5-3-2-4-6-13/h2-8,10-11H,9H2,1H3,(H,21,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of mouse full-length GST-tagged BRAF V600E mutant using recombinant human full length N-terminal His-tagged MEK1 as substrate preincubated...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50457923 (CHEMBL4209588) Show SMILES Cc1c([nH]c2ccc(Cl)cc12)C(=O)NC(CO)Cc1ccccc1 Show InChI InChI=1S/C19H19ClN2O2/c1-12-16-10-14(20)7-8-17(16)22-18(12)19(24)21-15(11-23)9-13-5-3-2-4-6-13/h2-8,10,15,22-23H,9,11H2,1H3,(H,21,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of His6-tagged EGFR (unknown origin) cytoplasmic domain expressed in baculovirus infected Sf9 insect cells after 10 mins followed by addit...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50457926 (CHEMBL4214496) Show SMILES OCC(Cc1ccccc1)NC(=O)c1cc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C18H17ClN2O2/c19-14-6-7-16-13(9-14)10-17(21-16)18(23)20-15(11-22)8-12-4-2-1-3-5-12/h1-7,9-10,15,21-22H,8,11H2,(H,20,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of His6-tagged EGFR (unknown origin) cytoplasmic domain expressed in baculovirus infected Sf9 insect cells after 10 mins followed by addit...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Mus musculus)	BDBM50457928 (CHEMBL4213146) Show SMILES CCc1c2cc(ccc2n2cc(Cc3ccccc3)[nH]c(=O)c12)C(F)(F)F Show InChI InChI=1S/C21H17F3N2O/c1-2-16-17-11-14(21(22,23)24)8-9-18(17)26-12-15(25-20(27)19(16)26)10-13-6-4-3-5-7-13/h3-9,11-12H,2,10H2,1H3,(H,25,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of mouse full-length GST-tagged BRAF V600E mutant using recombinant human full length N-terminal His-tagged MEK1 as substrate preincubated...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50457925 (CHEMBL4207316) Show SMILES CCc1c([nH]c2ccc(cc12)C(F)(F)F)C(=O)NC(CO)Cc1ccccc1 Show InChI InChI=1S/C21H21F3N2O2/c1-2-16-17-11-14(21(22,23)24)8-9-18(17)26-19(16)20(28)25-15(12-27)10-13-6-4-3-5-7-13/h3-9,11,15,26-27H,2,10,12H2,1H3,(H,25,28)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of His6-tagged EGFR (unknown origin) cytoplasmic domain expressed in baculovirus infected Sf9 insect cells after 10 mins followed by addit...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Mus musculus)	BDBM50457925 (CHEMBL4207316) Show SMILES CCc1c([nH]c2ccc(cc12)C(F)(F)F)C(=O)NC(CO)Cc1ccccc1 Show InChI InChI=1S/C21H21F3N2O2/c1-2-16-17-11-14(21(22,23)24)8-9-18(17)26-19(16)20(28)25-15(12-27)10-13-6-4-3-5-7-13/h3-9,11,15,26-27H,2,10,12H2,1H3,(H,25,28)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of mouse full-length GST-tagged BRAF V600E mutant using recombinant human full length N-terminal His-tagged MEK1 as substrate preincubated...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Mus musculus)	BDBM50457927 (CHEMBL4208745) Show SMILES Clc1ccc2c(cc3n2cc(Cc2ccccc2)[nH]c3=O)c1 Show InChI InChI=1S/C18H13ClN2O/c19-14-6-7-16-13(9-14)10-17-18(22)20-15(11-21(16)17)8-12-4-2-1-3-5-12/h1-7,9-11H,8H2,(H,20,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of mouse full-length GST-tagged BRAF V600E mutant using recombinant human full length N-terminal His-tagged MEK1 as substrate preincubated...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50457924 (CHEMBL4208224) Show SMILES Cc1c2cc(Cl)ccc2n2cc(Cc3ccccc3)[nH]c(=O)c12 Show InChI InChI=1S/C19H15ClN2O/c1-12-16-10-14(20)7-8-17(16)22-11-15(21-19(23)18(12)22)9-13-5-3-2-4-6-13/h2-8,10-11H,9H2,1H3,(H,21,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of His6-tagged EGFR (unknown origin) cytoplasmic domain expressed in baculovirus infected Sf9 insect cells after 10 mins followed by addit...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50457927 (CHEMBL4208745) Show SMILES Clc1ccc2c(cc3n2cc(Cc2ccccc2)[nH]c3=O)c1 Show InChI InChI=1S/C18H13ClN2O/c19-14-6-7-16-13(9-14)10-17-18(22)20-15(11-21(16)17)8-12-4-2-1-3-5-12/h1-7,9-11H,8H2,(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of His6-tagged EGFR (unknown origin) cytoplasmic domain expressed in baculovirus infected Sf9 insect cells after 10 mins followed by addit...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Mus musculus)	BDBM50457923 (CHEMBL4209588) Show SMILES Cc1c([nH]c2ccc(Cl)cc12)C(=O)NC(CO)Cc1ccccc1 Show InChI InChI=1S/C19H19ClN2O2/c1-12-16-10-14(20)7-8-17(16)22-18(12)19(24)21-15(11-23)9-13-5-3-2-4-6-13/h2-8,10,15,22-23H,9,11H2,1H3,(H,21,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of mouse full-length GST-tagged BRAF V600E mutant using recombinant human full length N-terminal His-tagged MEK1 as substrate preincubated...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50457928 (CHEMBL4213146) Show SMILES CCc1c2cc(ccc2n2cc(Cc3ccccc3)[nH]c(=O)c12)C(F)(F)F Show InChI InChI=1S/C21H17F3N2O/c1-2-16-17-11-14(21(22,23)24)8-9-18(17)26-12-15(25-20(27)19(16)26)10-13-6-4-3-5-7-13/h3-9,11-12H,2,10H2,1H3,(H,25,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of His6-tagged EGFR (unknown origin) cytoplasmic domain expressed in baculovirus infected Sf9 insect cells after 10 mins followed by addit...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase B-raf (Mus musculus)	BDBM50457926 (CHEMBL4214496) Show SMILES OCC(Cc1ccccc1)NC(=O)c1cc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C18H17ClN2O2/c19-14-6-7-16-13(9-14)10-17(21-16)18(23)20-15(11-22)8-12-4-2-1-3-5-12/h1-7,9-10,15,21-22H,8,11H2,(H,20,23)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Aljouf University Curated by ChEMBL					Assay Description Inhibition of mouse full-length GST-tagged BRAF V600E mutant using recombinant human full length N-terminal His-tagged MEK1 as substrate preincubated...				Eur J Med Chem 146: 260-273 (2018) Article DOI: 10.1016/j.ejmech.2018.01.042 BindingDB Entry DOI: 10.7270/Q25X2CKD
					More data for this Ligand-Target Pair