BDBM50288707 (R)-2-[(S)-1-((S)-3-Methyl-1-phenylcarbamoyl-butylcarbamoyl)-3-phenyl-propylamino]-6-phenylacetylamino-hexanoic acid::CHEMBL331364

SMILES: CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)N[C@H](CCCCNC(=O)Cc1ccccc1)C(O)=O)C(=O)Nc1ccccc1

InChI Key: InChIKey=RYSYGNANNWCOSN-QAXCHELISA-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 = 50288707   

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))	BDBM50288707 ((R)-2-[(S)-1-((S)-3-Methyl-1-phenylcarbamoyl-butyl...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)N[C@H](CCCCNC(=O)Cc1ccccc1)C(O)=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C36H46N4O5/c1-26(2)24-32(35(43)38-29-18-10-5-11-19-29)40-34(42)30(22-21-27-14-6-3-7-15-27)39-31(36(44)45)20-12-13-23-37-33(41)25-28-16-8-4-9-17-28/h3-11,14-19,26,30-32,39H,12-13,20-25H2,1-2H3,(H,37,41)(H,38,43)(H,40,42)(H,44,45)/t30-,31+,32-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of MMP-3.				Bioorg Med Chem Lett 6: 329-332 (1996) Article DOI: 10.1016/0960-894X(96)00024-8 BindingDB Entry DOI: 10.7270/Q2S75GBB
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50288707 ((R)-2-[(S)-1-((S)-3-Methyl-1-phenylcarbamoyl-butyl...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)N[C@H](CCCCNC(=O)Cc1ccccc1)C(O)=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C36H46N4O5/c1-26(2)24-32(35(43)38-29-18-10-5-11-19-29)40-34(42)30(22-21-27-14-6-3-7-15-27)39-31(36(44)45)20-12-13-23-37-33(41)25-28-16-8-4-9-17-28/h3-11,14-19,26,30-32,39H,12-13,20-25H2,1-2H3,(H,37,41)(H,38,43)(H,40,42)(H,44,45)/t30-,31+,32-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of MMP-2.				Bioorg Med Chem Lett 6: 329-332 (1996) Article DOI: 10.1016/0960-894X(96)00024-8 BindingDB Entry DOI: 10.7270/Q2S75GBB
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50288707 ((R)-2-[(S)-1-((S)-3-Methyl-1-phenylcarbamoyl-butyl...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)N[C@H](CCCCNC(=O)Cc1ccccc1)C(O)=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C36H46N4O5/c1-26(2)24-32(35(43)38-29-18-10-5-11-19-29)40-34(42)30(22-21-27-14-6-3-7-15-27)39-31(36(44)45)20-12-13-23-37-33(41)25-28-16-8-4-9-17-28/h3-11,14-19,26,30-32,39H,12-13,20-25H2,1-2H3,(H,37,41)(H,38,43)(H,40,42)(H,44,45)/t30-,31+,32-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of matrix metalloproteinase -1.				Bioorg Med Chem Lett 6: 329-332 (1996) Article DOI: 10.1016/0960-894X(96)00024-8 BindingDB Entry DOI: 10.7270/Q2S75GBB
					More data for this Ligand-Target Pair