Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Arginase-1' and Ligand = 'BDBM50538542'   

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
Arginase-1 (Homo sapiens (Human))	BDBM50538542 (CHEMBL4632863) Show SMILES [H][C@@]12C[C@](N)([C@@H](CCCB(O)O)[C@]1([H])C[C@@H](O)[C@H]2F)C(O)=O |r| Show InChI InChI=1S/C12H21BFNO5/c14-10-7-5-12(15,11(17)18)8(2-1-3-13(19)20)6(7)4-9(10)16/h6-10,16,19-20H,1-5,15H2,(H,17,18)/t6-,7-,8+,9-,10+,12+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
Merck & Co., Inc. Curated by ChEMBL					Assay Description Inhibition of human arginase1 in presence of DNTB by thio ornithine generation assay				ACS Med Chem Lett 11: 582-588 (2020) Article DOI: 10.1021/acsmedchemlett.0c00058 BindingDB Entry DOI: 10.7270/Q26113VN
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