Compile Data Set for Download or QSAR

Found 6 hits with Last Name = 'rondelet' and Initial = 'g'   

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
Coagulation factor XII (Homo sapiens (Human))	BDBM50146944 (CHEMBL3765536) Show SMILES Oc1ccc(Cl)cc1NC(=O)c1cc2cc(Cl)cc(Br)c2oc1=O Show InChI InChI=1S/C16H8BrCl2NO4/c17-11-5-9(19)3-7-4-10(16(23)24-14(7)11)15(22)20-12-6-8(18)1-2-13(12)21/h1-6,21H,(H,20,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Namur Curated by ChEMBL					Assay Description Inhibition of human factor 12a using S-2302 as substrate assessed as para-nitroaniline release preincubated for 10 mins followed by substrate additio...				Eur J Med Chem 110: 181-94 (2016) Article DOI: 10.1016/j.ejmech.2016.01.023 BindingDB Entry DOI: 10.7270/Q29G5PNX
					More data for this Ligand-Target Pair
Coagulation factor XII (Homo sapiens (Human))	BDBM50146992 (CHEMBL3763881) Show SMILES Oc1ccccc1NC(=O)c1cc2cc(Cl)cc(Br)c2oc1=O Show InChI InChI=1S/C16H9BrClNO4/c17-11-7-9(18)5-8-6-10(16(22)23-14(8)11)15(21)19-12-3-1-2-4-13(12)20/h1-7,20H,(H,19,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Namur Curated by ChEMBL					Assay Description Inhibition of human factor 12a using S-2302 as substrate assessed as para-nitroaniline release preincubated for 10 mins followed by substrate additio...				Eur J Med Chem 110: 181-94 (2016) Article DOI: 10.1016/j.ejmech.2016.01.023 BindingDB Entry DOI: 10.7270/Q29G5PNX
					More data for this Ligand-Target Pair
Coagulation factor XII (Homo sapiens (Human))	BDBM50146945 (CHEMBL3763678) Show SMILES Oc1cc(Cl)ccc1NC(=O)c1cc2cc(Cl)cc(Br)c2oc1=O Show InChI InChI=1S/C16H8BrCl2NO4/c17-11-5-9(19)3-7-4-10(16(23)24-14(7)11)15(22)20-12-2-1-8(18)6-13(12)21/h1-6,21H,(H,20,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Namur Curated by ChEMBL					Assay Description Inhibition of human factor 12a using S-2302 as substrate assessed as para-nitroaniline release preincubated for 10 mins followed by substrate additio...				Eur J Med Chem 110: 181-94 (2016) Article DOI: 10.1016/j.ejmech.2016.01.023 BindingDB Entry DOI: 10.7270/Q29G5PNX
					More data for this Ligand-Target Pair
Coagulation factor XII (Homo sapiens (Human))	BDBM23548 (3-Carboxamide-coumarin deriv., 44 | 8-bromo-6-chlo...) Show SMILES Clc1cc(Br)c2oc(=O)c(cc2c1)C(=O)Nc1ccccc1 Show InChI InChI=1S/C16H9BrClNO3/c17-13-8-10(18)6-9-7-12(16(21)22-14(9)13)15(20)19-11-4-2-1-3-5-11/h1-8H,(H,19,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Namur Curated by ChEMBL					Assay Description Inhibition of human factor 12a using S-2302 as substrate assessed as para-nitroaniline release preincubated for 10 mins followed by substrate additio...				Eur J Med Chem 110: 181-94 (2016) Article DOI: 10.1016/j.ejmech.2016.01.023 BindingDB Entry DOI: 10.7270/Q29G5PNX
					More data for this Ligand-Target Pair
Coagulation factor XII (Homo sapiens (Human))	BDBM50146947 (CHEMBL3764790) Show SMILES Oc1cccc(NC(=O)c2cc3cc(Cl)cc(Br)c3oc2=O)c1 Show InChI InChI=1S/C16H9BrClNO4/c17-13-6-9(18)4-8-5-12(16(22)23-14(8)13)15(21)19-10-2-1-3-11(20)7-10/h1-7,20H,(H,19,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Namur Curated by ChEMBL					Assay Description Inhibition of human factor 12a using S-2302 as substrate assessed as para-nitroaniline release preincubated for 10 mins followed by substrate additio...				Eur J Med Chem 110: 181-94 (2016) Article DOI: 10.1016/j.ejmech.2016.01.023 BindingDB Entry DOI: 10.7270/Q29G5PNX
					More data for this Ligand-Target Pair
Coagulation factor XII (Homo sapiens (Human))	BDBM50146946 (CHEMBL3763449) Show SMILES Oc1ccc(NC(=O)c2cc3cc(Cl)cc(Br)c3oc2=O)cc1 Show InChI InChI=1S/C16H9BrClNO4/c17-13-7-9(18)5-8-6-12(16(22)23-14(8)13)15(21)19-10-1-3-11(20)4-2-10/h1-7,20H,(H,19,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Namur Curated by ChEMBL					Assay Description Inhibition of human factor 12a using S-2302 as substrate assessed as para-nitroaniline release preincubated for 10 mins followed by substrate additio...				Eur J Med Chem 110: 181-94 (2016) Article DOI: 10.1016/j.ejmech.2016.01.023 BindingDB Entry DOI: 10.7270/Q29G5PNX
					More data for this Ligand-Target Pair