BDBM50129202 (S)-2-Amino-4-methyl-pentanoic acid hydroxyamide::(S)-2-amino-N-hydroxy-4-methylpentanamide::CHEMBL303296::L-LEUCYL-HYDROXYLAMINE

SMILES: CC(C)C[C@H](N)C(=O)NO

InChI Key: InChIKey=UJJHPFLWSVFLBE-YFKPBYRVSA-N

Data: 1 KI  1 IC50  1 Kd

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50129202   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Bacterial leucyl aminopeptidase (Vibrio proteolyticus)	BDBM50129202 ((S)-2-Amino-4-methyl-pentanoic acid hydroxyamide |...) Show SMILES CC(C)C[C@H](N)C(=O)NO Show InChI InChI=1S/C6H14N2O2/c1-4(2)3-5(7)6(9)8-10/h4-5,10H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1	PDB MMDB UniProtKB/SwissProt DrugBank GoogleScholar	Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	350	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Guilford Pharmaceuticals Inc Curated by ChEMBL					Assay Description Inhibition of metalloprotease from family M28, Aeromonas proteolytica aminopeptidase				Bioorg Med Chem Lett 13: 2097-100 (2003) Article DOI: 10.1016/s0960-894x(03)00407-4 BindingDB Entry DOI: 10.7270/Q2Z60NF2
					More data for this Ligand-Target Pair
Large neutral amino acids transporter small subunit 1 (Homo sapiens (Human))	BDBM50129202 ((S)-2-Amino-4-methyl-pentanoic acid hydroxyamide |...) Show SMILES CC(C)C[C@H](N)C(=O)NO Show InChI InChI=1S/C6H14N2O2/c1-4(2)3-5(7)6(9)8-10/h4-5,10H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1	PDB Reactome pathway UniProtKB/SwissProt antibodypedia GoogleScholar	Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of California San Francisco Curated by ChEMBL					Assay Description Inhibition of human LAT1 expressed in HEK293-T-Rex cells assessed as inhibition of [3H]-gabapentin uptake by scintillation counting cis-inhibition as...				Bioorg Med Chem Lett 26: 5000-5006 (2016)
					More data for this Ligand-Target Pair
Thermolysin (Bacillus thermoproteolyticus)	BDBM50129202 ((S)-2-Amino-4-methyl-pentanoic acid hydroxyamide |...) Show SMILES CC(C)C[C@H](N)C(=O)NO Show InChI InChI=1S/C6H14N2O2/c1-4(2)3-5(7)6(9)8-10/h4-5,10H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1	PDB MMDB UniProtKB/SwissProt DrugBank GoogleScholar	Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	n/a	1.91E+5	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Binding affinity against Thermolysin				J Med Chem 45: 2770-80 (2002) Article DOI: 10.1021/jm0105833 BindingDB Entry DOI: 10.7270/Q2MG7S8S
					More data for this Ligand-Target Pair				3D Structure (crystal)