Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 6' and Ligand = 'BDBM50503781'   

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
Carbonic anhydrase 6 (Homo sapiens (Human))	BDBM50503781 (CHEMBL4464359) Show SMILES Cc1cc(N2CC(CC2=O)C(=O)NNC(=S)Nc2ccccc2)c(Cl)c(C)c1S(N)(=O)=O Show InChI InChI=1S/C20H22ClN5O4S2/c1-11-8-15(17(21)12(2)18(11)32(22,29)30)26-10-13(9-16(26)27)19(28)24-25-20(31)23-14-6-4-3-5-7-14/h3-8,13H,9-10H2,1-2H3,(H,24,28)(H2,22,29,30)(H2,23,25,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a
Kaunas University of Technology Curated by ChEMBL					Assay Description Binding affinity to recombinant human CA6 by DSF-based fluorescence thermal shift assay				Bioorg Med Chem 27: 322-337 (2019) Article DOI: 10.1016/j.bmc.2018.12.011 BindingDB Entry DOI: 10.7270/Q25M68ZH
					More data for this Ligand-Target Pair
Carbonic anhydrase 6 (Homo sapiens (Human))	BDBM50503781 (CHEMBL4464359) Show SMILES Cc1cc(N2CC(CC2=O)C(=O)NNC(=S)Nc2ccccc2)c(Cl)c(C)c1S(N)(=O)=O Show InChI InChI=1S/C20H22ClN5O4S2/c1-11-8-15(17(21)12(2)18(11)32(22,29)30)26-10-13(9-16(26)27)19(28)24-25-20(31)23-14-6-4-3-5-7-14/h3-8,13H,9-10H2,1-2H3,(H,24,28)(H2,22,29,30)(H2,23,25,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	0.25	n/a	n/a	n/a	n/a	n/a
Kaunas University of Technology Curated by ChEMBL					Assay Description Binding affinity to recombinant human CA6 assessed as intrinsic dissociation constant by DSF-based fluorescence thermal shift assay				Bioorg Med Chem 27: 322-337 (2019) Article DOI: 10.1016/j.bmc.2018.12.011 BindingDB Entry DOI: 10.7270/Q25M68ZH
					More data for this Ligand-Target Pair