null

SMILES: CCc1cc(cc(OC)c1Cl)C1CCN(CC1)C(=O)CC[C@@]1(COC)NC(=O)NC1=O

InChI Key: InChIKey=CGAHNRKQXVGYMJ-QFIPXVFZSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 429782   

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
A disintegrin and metalloproteinase with thrombospondin motifs 5 (Homo sapiens (Human))	BDBM429782 ((5R)-5-[3-[4- (4-chloro-3- ethyl-5- methoxy- pheny...) Show SMILES CCc1cc(cc(OC)c1Cl)C1CCN(CC1)C(=O)CC[C@@]1(COC)NC(=O)NC1=O |r| Show InChI InChI=1S/C22H30ClN3O5/c1-4-14-11-16(12-17(31-3)19(14)23)15-6-9-26(10-7-15)18(27)5-8-22(13-30-2)20(28)24-21(29)25-22/h11-12,15H,4-10,13H2,1-3H3,(H2,24,25,28,29)/t22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
GALAPAGOS NV US Patent					Assay Description The basis for the assay is the cleavage of the substrate TBIS-1 (5 FAM-TEGEARGSVILLK (5TAMRA)K-NH2) (SEQ ID NO: 2) by human ADAMTS-5.For the dose res...				US Patent US10550100 (2020) BindingDB Entry DOI: 10.7270/Q2D2211N
					More data for this Ligand-Target Pair
A disintegrin and metalloproteinase with thrombospondin motifs 6 (Human)	BDBM429782 ((5R)-5-[3-[4- (4-chloro-3- ethyl-5- methoxy- pheny...) Show SMILES CCc1cc(cc(OC)c1Cl)C1CCN(CC1)C(=O)CC[C@@]1(COC)NC(=O)NC1=O |r| Show InChI InChI=1S/C22H30ClN3O5/c1-4-14-11-16(12-17(31-3)19(14)23)15-6-9-26(10-7-15)18(27)5-8-22(13-30-2)20(28)24-21(29)25-22/h11-12,15H,4-10,13H2,1-3H3,(H2,24,25,28,29)/t22-/m0/s1	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	12.5	n/a	n/a	n/a	n/a	n/a	n/a
GALAPAGOS NV US Patent					Assay Description The basis for the assay is the cleavage of the substrate 520 MMP FRET substrate XII by human ADAMTS6.The substrate contains sequence Arg-Pro-Lys-Pro-...				US Patent US10550100 (2020) BindingDB Entry DOI: 10.7270/Q2D2211N
					More data for this Ligand-Target Pair
Matrix metalloproteinase-14 (Homo sapiens (Human))	BDBM429782 ((5R)-5-[3-[4- (4-chloro-3- ethyl-5- methoxy- pheny...) Show SMILES CCc1cc(cc(OC)c1Cl)C1CCN(CC1)C(=O)CC[C@@]1(COC)NC(=O)NC1=O |r| Show InChI InChI=1S/C22H30ClN3O5/c1-4-14-11-16(12-17(31-3)19(14)23)15-6-9-26(10-7-15)18(27)5-8-22(13-30-2)20(28)24-21(29)25-22/h11-12,15H,4-10,13H2,1-3H3,(H2,24,25,28,29)/t22-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
GALAPAGOS NV US Patent					Assay Description The basis for the assay is the cleavage of the substrate 390 MMP FRET Substrate I (Anaspec Cat# AS-27076) by human MMP14 (Biomol, Cat#SE-259).For the...				US Patent US10550100 (2020) BindingDB Entry DOI: 10.7270/Q2D2211N
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM429782 ((5R)-5-[3-[4- (4-chloro-3- ethyl-5- methoxy- pheny...) Show SMILES CCc1cc(cc(OC)c1Cl)C1CCN(CC1)C(=O)CC[C@@]1(COC)NC(=O)NC1=O |r| Show InChI InChI=1S/C22H30ClN3O5/c1-4-14-11-16(12-17(31-3)19(14)23)15-6-9-26(10-7-15)18(27)5-8-22(13-30-2)20(28)24-21(29)25-22/h11-12,15H,4-10,13H2,1-3H3,(H2,24,25,28,29)/t22-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
GALAPAGOS NV US Patent					Assay Description The basis for the assay is the cleavage of the substrate 390 MMP FRET Substrate I (Anaspec Cat# AS-27076) by human MMP13 (Chemicon, Cat#CC068).For th...				US Patent US10550100 (2020) BindingDB Entry DOI: 10.7270/Q2D2211N
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM429782 ((5R)-5-[3-[4- (4-chloro-3- ethyl-5- methoxy- pheny...) Show SMILES CCc1cc(cc(OC)c1Cl)C1CCN(CC1)C(=O)CC[C@@]1(COC)NC(=O)NC1=O |r| Show InChI InChI=1S/C22H30ClN3O5/c1-4-14-11-16(12-17(31-3)19(14)23)15-6-9-26(10-7-15)18(27)5-8-22(13-30-2)20(28)24-21(29)25-22/h11-12,15H,4-10,13H2,1-3H3,(H2,24,25,28,29)/t22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a	n/a
GALAPAGOS NV US Patent					Assay Description The basis for the assay is the cleavage of the substrate 5FAM-LAQAVRSSSRK-5TAMRA (SEQ ID No 3) (Anaspec, custom 34891) by human TACE (R&D SYSTEMS INC...				US Patent US10550100 (2020) BindingDB Entry DOI: 10.7270/Q2D2211N
					More data for this Ligand-Target Pair