BDBM50063919 (2R,3R)-N*4*-Hydroxy-2-isobutyl-N*1*-((S)-methylcarbamoyl-phenyl-methyl)-3-morpholin-4-ylmethyl-succinamide::CHEMBL433816

SMILES: CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](CN1CCOCC1)C(=O)NO)c1ccccc1

InChI Key: InChIKey=DYKLASPWVUKEIT-QYZOEREBSA-N

Data: 4 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 = 50063919   

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
Matrix metalloproteinase-14 (MMP14) (Homo sapiens (Human))	BDBM50063919 ((2R,3R)-N*4*-Hydroxy-2-isobutyl-N*1*-((S)-methylca...) Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](CN1CCOCC1)C(=O)NO)c1ccccc1 Show InChI InChI=1S/C22H34N4O5/c1-15(2)13-17(18(21(28)25-30)14-26-9-11-31-12-10-26)20(27)24-19(22(29)23-3)16-7-5-4-6-8-16/h4-8,15,17-19,30H,9-14H2,1-3H3,(H,23,29)(H,24,27)(H,25,28)/t17-,18+,19+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
Kanebo Ltd. Curated by ChEMBL					Assay Description Activity against deletion mutant of MT1-MMP lacking the transmembrane domain (deltaMT1)				J Med Chem 41: 1209-17 (1998) Article DOI: 10.1021/jm970404a BindingDB Entry DOI: 10.7270/Q2SQ8ZHB
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50063919 ((2R,3R)-N*4*-Hydroxy-2-isobutyl-N*1*-((S)-methylca...) Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](CN1CCOCC1)C(=O)NO)c1ccccc1 Show InChI InChI=1S/C22H34N4O5/c1-15(2)13-17(18(21(28)25-30)14-26-9-11-31-12-10-26)20(27)24-19(22(29)23-3)16-7-5-4-6-8-16/h4-8,15,17-19,30H,9-14H2,1-3H3,(H,23,29)(H,24,27)(H,25,28)/t17-,18+,19+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	n/a
Kanebo Ltd. Curated by ChEMBL					Assay Description Activity against Matrix metalloproteinase-1 (MMP-1).				J Med Chem 41: 1209-17 (1998) Article DOI: 10.1021/jm970404a BindingDB Entry DOI: 10.7270/Q2SQ8ZHB
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50063919 ((2R,3R)-N*4*-Hydroxy-2-isobutyl-N*1*-((S)-methylca...) Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](CN1CCOCC1)C(=O)NO)c1ccccc1 Show InChI InChI=1S/C22H34N4O5/c1-15(2)13-17(18(21(28)25-30)14-26-9-11-31-12-10-26)20(27)24-19(22(29)23-3)16-7-5-4-6-8-16/h4-8,15,17-19,30H,9-14H2,1-3H3,(H,23,29)(H,24,27)(H,25,28)/t17-,18+,19+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
Kanebo Ltd. Curated by ChEMBL					Assay Description Activity against Matrix metalloproteinase-3 (MMP-3).				J Med Chem 41: 1209-17 (1998) Article DOI: 10.1021/jm970404a BindingDB Entry DOI: 10.7270/Q2SQ8ZHB
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50063919 ((2R,3R)-N*4*-Hydroxy-2-isobutyl-N*1*-((S)-methylca...) Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@H](CN1CCOCC1)C(=O)NO)c1ccccc1 Show InChI InChI=1S/C22H34N4O5/c1-15(2)13-17(18(21(28)25-30)14-26-9-11-31-12-10-26)20(27)24-19(22(29)23-3)16-7-5-4-6-8-16/h4-8,15,17-19,30H,9-14H2,1-3H3,(H,23,29)(H,24,27)(H,25,28)/t17-,18+,19+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Kanebo Ltd. Curated by ChEMBL					Assay Description Activity against Matrix metalloproteinase-9 (MMP-9).				J Med Chem 41: 1209-17 (1998) Article DOI: 10.1021/jm970404a BindingDB Entry DOI: 10.7270/Q2SQ8ZHB
					More data for this Ligand-Target Pair