Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium/hydrogen exchanger 3' and Ligand = 'BDBM381792'   

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 (Rattus norvegicus)	BDBM381792 (US10272079, Compound 149) Show SMILES CN(C)[C@H]1Cc2c(cc(Cl)cc2Cl)[C@@H]1Oc1ccc(cc1)S(=O)(=O)NCCOCCOCCNC(=O)COCC(=O)NCCOCCOCCNS(=O)(=O)c1ccc(O[C@@H]2[C@H](Cc3c2cc(Cl)cc3Cl)N(C)C)cc1 |r| Show InChI InChI=1S/C50H64Cl4N6O13S2/c1-59(2)45-29-39-41(25-33(51)27-43(39)53)49(45)72-35-5-9-37(10-6-35)74(63,64)57-15-19-69-23-21-67-17-13-55-47(61)31-71-32-48(62)56-14-18-68-22-24-70-20-16-58-75(65,66)38-11-7-36(8-12-38)73-50-42-26-34(52)28-44(54)40(42)30-46(50)60(3)4/h5-12,25-28,45-46,49-50,57-58H,13-24,29-32H2,1-4H3,(H,55,61)(H,56,62)/t45-,46-,49-,50-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.94	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 (Homo sapiens (Human))	BDBM381792 (US10272079, Compound 149) Show SMILES CN(C)[C@H]1Cc2c(cc(Cl)cc2Cl)[C@@H]1Oc1ccc(cc1)S(=O)(=O)NCCOCCOCCNC(=O)COCC(=O)NCCOCCOCCNS(=O)(=O)c1ccc(O[C@@H]2[C@H](Cc3c2cc(Cl)cc3Cl)N(C)C)cc1 |r| Show InChI InChI=1S/C50H64Cl4N6O13S2/c1-59(2)45-29-39-41(25-33(51)27-43(39)53)49(45)72-35-5-9-37(10-6-35)74(63,64)57-15-19-69-23-21-67-17-13-55-47(61)31-71-32-48(62)56-14-18-68-22-24-70-20-16-58-75(65,66)38-11-7-36(8-12-38)73-50-42-26-34(52)28-44(54)40(42)30-46(50)60(3)4/h5-12,25-28,45-46,49-50,57-58H,13-24,29-32H2,1-4H3,(H,55,61)(H,56,62)/t45-,46-,49-,50-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10	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