Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 6' and Ligand = 'BDBM50503813'   

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))	BDBM50503813 (CHEMBL4457904) Show SMILES Cc1cc(N2CC(CC2=O)c2n[nH]c(=S)o2)c(Cl)c(C)c1S(N)(=O)=O Show InChI InChI=1S/C14H15ClN4O4S2/c1-6-3-9(11(15)7(2)12(6)25(16,21)22)19-5-8(4-10(19)20)13-17-18-14(24)23-13/h3,8H,4-5H2,1-2H3,(H,18,24)(H2,16,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	3.30E+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))	BDBM50503813 (CHEMBL4457904) Show SMILES Cc1cc(N2CC(CC2=O)c2n[nH]c(=S)o2)c(Cl)c(C)c1S(N)(=O)=O Show InChI InChI=1S/C14H15ClN4O4S2/c1-6-3-9(11(15)7(2)12(6)25(16,21)22)19-5-8(4-10(19)20)13-17-18-14(24)23-13/h3,8H,4-5H2,1-2H3,(H,18,24)(H2,16,21,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	0.380	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