BDBM50285574 (R)-2-((S)-1-((S)-4-methyl-1-oxo-1-(phenylamino)pentan-2-ylamino)-1-oxo-4-p-tolylbutan-2-ylamino)propanoic acid::(R)-2-[(S)-1-((S)-3-Methyl-1-phenylcarbamoyl-butylcarbamoyl)-3-p-tolyl-propylamino]-propionic acid::CHEMBL310834

SMILES: CC(C)C[C@H](NC(=O)[C@H](CCc1ccc(C)cc1)N[C@H](C)C(O)=O)C(=O)Nc1ccccc1

InChI Key: InChIKey=ZKTSRBGPYOEYPS-OIBXWCBGSA-N

Data: 3 KI

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 3 hits for monomerid = 50285574   

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))	BDBM50285574 ((R)-2-((S)-1-((S)-4-methyl-1-oxo-1-(phenylamino)pe...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCc1ccc(C)cc1)N[C@H](C)C(O)=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C26H35N3O4/c1-17(2)16-23(25(31)28-21-8-6-5-7-9-21)29-24(30)22(27-19(4)26(32)33)15-14-20-12-10-18(3)11-13-20/h5-13,17,19,22-23,27H,14-16H2,1-4H3,(H,28,31)(H,29,30)(H,32,33)/t19-,22+,23+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity against human stromelysin-3 (MMP-3)				Bioorg Med Chem Lett 5: 2441-2446 (1995) Article DOI: 10.1016/0960-894X(95)00425-S BindingDB Entry DOI: 10.7270/Q2D21XK6
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50285574 ((R)-2-((S)-1-((S)-4-methyl-1-oxo-1-(phenylamino)pe...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCc1ccc(C)cc1)N[C@H](C)C(O)=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C26H35N3O4/c1-17(2)16-23(25(31)28-21-8-6-5-7-9-21)29-24(30)22(27-19(4)26(32)33)15-14-20-12-10-18(3)11-13-20/h5-13,17,19,22-23,27H,14-16H2,1-4H3,(H,28,31)(H,29,30)(H,32,33)/t19-,22+,23+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pomona College Curated by ChEMBL					Assay Description Inhibition of MMP3				Bioorg Med Chem 15: 2223-68 (2007) Article DOI: 10.1016/j.bmc.2007.01.011 BindingDB Entry DOI: 10.7270/Q2571DBD
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50285574 ((R)-2-((S)-1-((S)-4-methyl-1-oxo-1-(phenylamino)pe...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCc1ccc(C)cc1)N[C@H](C)C(O)=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C26H35N3O4/c1-17(2)16-23(25(31)28-21-8-6-5-7-9-21)29-24(30)22(27-19(4)26(32)33)15-14-20-12-10-18(3)11-13-20/h5-13,17,19,22-23,27H,14-16H2,1-4H3,(H,28,31)(H,29,30)(H,32,33)/t19-,22+,23+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity against human collagenase (MMP-1)				Bioorg Med Chem Lett 5: 2441-2446 (1995) Article DOI: 10.1016/0960-894X(95)00425-S BindingDB Entry DOI: 10.7270/Q2D21XK6
					More data for this Ligand-Target Pair