Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium/hydrogen exchanger 3' and Ligand = 'BDBM381667'   

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
Sodium/hydrogen exchanger 3 (Homo sapiens (Human))	BDBM381667 (US10272079, Compound 24) Show SMILES CCNC(=O)CCOCCOCCOCCOCCOCCC(=O)NCCOCCOCCOCCN1CCN(CC1)c1ccc(cc1)-c1nc(NC(N)=N)nc2ccc(Cl)cc12 Show InChI InChI=1S/C43H66ClN9O10/c1-2-47-39(54)9-17-56-21-25-60-29-31-63-32-30-61-26-22-57-18-10-40(55)48-11-19-58-23-27-62-28-24-59-20-16-52-12-14-53(15-13-52)36-6-3-34(4-7-36)41-37-33-35(44)5-8-38(37)49-43(50-41)51-42(45)46/h3-8,33H,2,9-32H2,1H3,(H,47,54)(H,48,55)(H4,45,46,49,50,51)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.63	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline					Assay Description Cell-based activity under Prompt Conditions. Rat or human NHE3-mediated Na+-dependent H+ antiport was measured using a modification of the pH sensiti...				J Med Chem 51: 5663-79 (2008) BindingDB Entry DOI: 10.7270/Q2251MHH
					More data for this Ligand-Target Pair
Sodium/hydrogen exchanger 3 (Rattus norvegicus)	BDBM381667 (US10272079, Compound 24) Show SMILES CCNC(=O)CCOCCOCCOCCOCCOCCC(=O)NCCOCCOCCOCCN1CCN(CC1)c1ccc(cc1)-c1nc(NC(N)=N)nc2ccc(Cl)cc12 Show InChI InChI=1S/C43H66ClN9O10/c1-2-47-39(54)9-17-56-21-25-60-29-31-63-32-30-61-26-22-57-18-10-40(55)48-11-19-58-23-27-62-28-24-59-20-16-52-12-14-53(15-13-52)36-6-3-34(4-7-36)41-37-33-35(44)5-8-38(37)49-43(50-41)51-42(45)46/h3-8,33H,2,9-32H2,1H3,(H,47,54)(H,48,55)(H4,45,46,49,50,51)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	20.9	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline					Assay Description Cell-based activity under Prompt Conditions. Rat or human NHE3-mediated Na+-dependent H+ antiport was measured using a modification of the pH sensiti...				J Med Chem 51: 5663-79 (2008) BindingDB Entry DOI: 10.7270/Q2251MHH
					More data for this Ligand-Target Pair