BDBM50043804 5-(2-Amino-3-phenyl-propionylamino)-3-isobutyl-7-methyl-4-oxo-octanoic acid hydroxyamide::CHEMBL440124

SMILES: CC(C)CC(CC(=O)NO)C(=O)C(CC(C)C)NC(=O)C(N)Cc1ccccc1

InChI Key: InChIKey=IDOUEUWKDVPZSO-UHFFFAOYSA-N

Data: 2 KI  2 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 4 hits for monomerid = 50043804   

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
Stromelysin-1 (Homo sapiens (Human))	BDBM50043804 (5-(2-Amino-3-phenyl-propionylamino)-3-isobutyl-7-m...) Show SMILES CC(C)CC(CC(=O)NO)C(=O)C(CC(C)C)NC(=O)C(N)Cc1ccccc1 Show InChI InChI=1S/C22H35N3O4/c1-14(2)10-17(13-20(26)25-29)21(27)19(11-15(3)4)24-22(28)18(23)12-16-8-6-5-7-9-16/h5-9,14-15,17-19,29H,10-13,23H2,1-4H3,(H,24,28)(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibition of recombinant full length stromelysin (FLS)				J Med Chem 37: 206-9 (1994) BindingDB Entry DOI: 10.7270/Q2X34WH1
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50043804 (5-(2-Amino-3-phenyl-propionylamino)-3-isobutyl-7-m...) Show SMILES CC(C)CC(CC(=O)NO)C(=O)C(CC(C)C)NC(=O)C(N)Cc1ccccc1 Show InChI InChI=1S/C22H35N3O4/c1-14(2)10-17(13-20(26)25-29)21(27)19(11-15(3)4)24-22(28)18(23)12-16-8-6-5-7-9-16/h5-9,14-15,17-19,29H,10-13,23H2,1-4H3,(H,24,28)(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibition of recombinant stromelysin catalytic domain (SCD)				J Med Chem 37: 206-9 (1994) BindingDB Entry DOI: 10.7270/Q2X34WH1
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50043804 (5-(2-Amino-3-phenyl-propionylamino)-3-isobutyl-7-m...) Show SMILES CC(C)CC(CC(=O)NO)C(=O)C(CC(C)C)NC(=O)C(N)Cc1ccccc1 Show InChI InChI=1S/C22H35N3O4/c1-14(2)10-17(13-20(26)25-29)21(27)19(11-15(3)4)24-22(28)18(23)12-16-8-6-5-7-9-16/h5-9,14-15,17-19,29H,10-13,23H2,1-4H3,(H,24,28)(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibition of recombinant full length stromelysin (FLS).				J Med Chem 37: 206-9 (1994) BindingDB Entry DOI: 10.7270/Q2X34WH1
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50043804 (5-(2-Amino-3-phenyl-propionylamino)-3-isobutyl-7-m...) Show SMILES CC(C)CC(CC(=O)NO)C(=O)C(CC(C)C)NC(=O)C(N)Cc1ccccc1 Show InChI InChI=1S/C22H35N3O4/c1-14(2)10-17(13-20(26)25-29)21(27)19(11-15(3)4)24-22(28)18(23)12-16-8-6-5-7-9-16/h5-9,14-15,17-19,29H,10-13,23H2,1-4H3,(H,24,28)(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description In vitro inhibition of recombinant stromelysin catalytic domain.				J Med Chem 37: 206-9 (1994) BindingDB Entry DOI: 10.7270/Q2X34WH1
					More data for this Ligand-Target Pair