BDBM50538544 CHEMBL4632821

SMILES: [H][C@@]12C[C@](N)([C@@H](CCCB(O)O)[C@]1([H])C[C@@H](NC)[C@H]2F)C(O)=O

InChI Key: InChIKey=MGCHZOBLCXFANK-JYMMUIJESA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50538544   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Arginase-1 (Homo sapiens (Human))	BDBM50538544 (CHEMBL4632821) Show SMILES [H][C@@]12C[C@](N)([C@@H](CCCB(O)O)[C@]1([H])C[C@@H](NC)[C@H]2F)C(O)=O |r| Show InChI InChI=1S/C13H24BFN2O4/c1-17-10-5-7-8(11(10)15)6-13(16,12(18)19)9(7)3-2-4-14(20)21/h7-11,17,20-21H,2-6,16H2,1H3,(H,18,19)/t7-,8-,9+,10-,11+,13+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	23	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)
					More data for this Ligand-Target Pair