BDBM50195915 4-((2-methylquinolin-4-yl)methoxy)-N-((2,4,6-trioxo-5-(1-(tetrahydro-2H-pyran-4-yl)piperidin-4-yl)-hexahydropyrimidin-5-yl)methyl)benzamide::CHEMBL240648

SMILES: Cc1cc(COc2ccc(cc2)C(=O)NCC2(C3CCN(CC3)C3CCOCC3)C(=O)NC(=O)NC2=O)c2ccccc2n1

InChI Key: InChIKey=JAJGEGVZSPWXRV-UHFFFAOYSA-N

Data: 4 KI  1 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 5 hits for monomerid = 50195915   

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
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50195915 (4-((2-methylquinolin-4-yl)methoxy)-N-((2,4,6-triox...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NCC2(C3CCN(CC3)C3CCOCC3)C(=O)NC(=O)NC2=O)c2ccccc2n1 Show InChI InChI=1S/C33H37N5O6/c1-21-18-23(27-4-2-3-5-28(27)35-21)19-44-26-8-6-22(7-9-26)29(39)34-20-33(30(40)36-32(42)37-31(33)41)24-10-14-38(15-11-24)25-12-16-43-17-13-25/h2-9,18,24-25H,10-17,19-20H2,1H3,(H,34,39)(H2,36,37,40,41,42)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>3.33E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of MMP2				Bioorg Med Chem Lett 17: 266-71 (2006) Article DOI: 10.1016/j.bmcl.2006.09.048 BindingDB Entry DOI: 10.7270/Q2NK3DPF
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50195915 (4-((2-methylquinolin-4-yl)methoxy)-N-((2,4,6-triox...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NCC2(C3CCN(CC3)C3CCOCC3)C(=O)NC(=O)NC2=O)c2ccccc2n1 Show InChI InChI=1S/C33H37N5O6/c1-21-18-23(27-4-2-3-5-28(27)35-21)19-44-26-8-6-22(7-9-26)29(39)34-20-33(30(40)36-32(42)37-31(33)41)24-10-14-38(15-11-24)25-12-16-43-17-13-25/h2-9,18,24-25H,10-17,19-20H2,1H3,(H,34,39)(H2,36,37,40,41,42)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of MMP3				Bioorg Med Chem Lett 17: 266-71 (2006) Article DOI: 10.1016/j.bmcl.2006.09.048 BindingDB Entry DOI: 10.7270/Q2NK3DPF
					More data for this Ligand-Target Pair
Macrophage metalloelastase (Homo sapiens (Human))	BDBM50195915 (4-((2-methylquinolin-4-yl)methoxy)-N-((2,4,6-triox...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NCC2(C3CCN(CC3)C3CCOCC3)C(=O)NC(=O)NC2=O)c2ccccc2n1 Show InChI InChI=1S/C33H37N5O6/c1-21-18-23(27-4-2-3-5-28(27)35-21)19-44-26-8-6-22(7-9-26)29(39)34-20-33(30(40)36-32(42)37-31(33)41)24-10-14-38(15-11-24)25-12-16-43-17-13-25/h2-9,18,24-25H,10-17,19-20H2,1H3,(H,34,39)(H2,36,37,40,41,42)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>6.02E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of MMP12				Bioorg Med Chem Lett 17: 266-71 (2006) Article DOI: 10.1016/j.bmcl.2006.09.048 BindingDB Entry DOI: 10.7270/Q2NK3DPF
					More data for this Ligand-Target Pair
Matrilysin (Homo sapiens (Human))	BDBM50195915 (4-((2-methylquinolin-4-yl)methoxy)-N-((2,4,6-triox...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NCC2(C3CCN(CC3)C3CCOCC3)C(=O)NC(=O)NC2=O)c2ccccc2n1 Show InChI InChI=1S/C33H37N5O6/c1-21-18-23(27-4-2-3-5-28(27)35-21)19-44-26-8-6-22(7-9-26)29(39)34-20-33(30(40)36-32(42)37-31(33)41)24-10-14-38(15-11-24)25-12-16-43-17-13-25/h2-9,18,24-25H,10-17,19-20H2,1H3,(H,34,39)(H2,36,37,40,41,42)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>6.37E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of MMP7				Bioorg Med Chem Lett 17: 266-71 (2006) Article DOI: 10.1016/j.bmcl.2006.09.048 BindingDB Entry DOI: 10.7270/Q2NK3DPF
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Sus scrofa (pig))	BDBM50195915 (4-((2-methylquinolin-4-yl)methoxy)-N-((2,4,6-triox...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NCC2(C3CCN(CC3)C3CCOCC3)C(=O)NC(=O)NC2=O)c2ccccc2n1 Show InChI InChI=1S/C33H37N5O6/c1-21-18-23(27-4-2-3-5-28(27)35-21)19-44-26-8-6-22(7-9-26)29(39)34-20-33(30(40)36-32(42)37-31(33)41)24-10-14-38(15-11-24)25-12-16-43-17-13-25/h2-9,18,24-25H,10-17,19-20H2,1H3,(H,34,39)(H2,36,37,40,41,42)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of porcine TACE				Bioorg Med Chem Lett 17: 266-71 (2006) Article DOI: 10.1016/j.bmcl.2006.09.048 BindingDB Entry DOI: 10.7270/Q2NK3DPF
					More data for this Ligand-Target Pair