BDBM50132634 (2R,3S)-4-Acetyl-3-methyl-1-[4-(2-methyl-pyridin-3-ylmethoxy)-benzenesulfonyl]-piperazine-2-carboxylic acid hydroxyamide::CHEMBL110211

SMILES: C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2cccnc2C)cc1)C(=O)NO

InChI Key: InChIKey=HEJQAFMDGAOYSZ-MGPUTAFESA-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 = 50132634   

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
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50132634 ((2R,3S)-4-Acetyl-3-methyl-1-[4-(2-methyl-pyridin-3...) Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2cccnc2C)cc1)C(=O)NO Show InChI InChI=1S/C21H26N4O6S/c1-14-17(5-4-10-22-14)13-31-18-6-8-19(9-7-18)32(29,30)25-12-11-24(16(3)26)15(2)20(25)21(27)23-28/h4-10,15,20,28H,11-13H2,1-3H3,(H,23,27)/t15-,20+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of human recombinant tumor necrosis factor-alpha converting enzyme.				Bioorg Med Chem Lett 13: 3243-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q23ZMM
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50132634 ((2R,3S)-4-Acetyl-3-methyl-1-[4-(2-methyl-pyridin-3...) Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2cccnc2C)cc1)C(=O)NO Show InChI InChI=1S/C21H26N4O6S/c1-14-17(5-4-10-22-14)13-31-18-6-8-19(9-7-18)32(29,30)25-12-11-24(16(3)26)15(2)20(25)21(27)23-28/h4-10,15,20,28H,11-13H2,1-3H3,(H,23,27)/t15-,20+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of Tumor necrosis factor-alpha (TNF-alpha) release in human whole blood				Bioorg Med Chem Lett 13: 3243-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q23ZMM
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50132634 ((2R,3S)-4-Acetyl-3-methyl-1-[4-(2-methyl-pyridin-3...) Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2cccnc2C)cc1)C(=O)NO Show InChI InChI=1S/C21H26N4O6S/c1-14-17(5-4-10-22-14)13-31-18-6-8-19(9-7-18)32(29,30)25-12-11-24(16(3)26)15(2)20(25)21(27)23-28/h4-10,15,20,28H,11-13H2,1-3H3,(H,23,27)/t15-,20+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description In vitro inhibition of matrix metalloprotease-1.				Bioorg Med Chem Lett 13: 3243-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q23ZMM
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50132634 ((2R,3S)-4-Acetyl-3-methyl-1-[4-(2-methyl-pyridin-3...) Show SMILES C[C@H]1[C@@H](N(CCN1C(C)=O)S(=O)(=O)c1ccc(OCc2cccnc2C)cc1)C(=O)NO Show InChI InChI=1S/C21H26N4O6S/c1-14-17(5-4-10-22-14)13-31-18-6-8-19(9-7-18)32(29,30)25-12-11-24(16(3)26)15(2)20(25)21(27)23-28/h4-10,15,20,28H,11-13H2,1-3H3,(H,23,27)/t15-,20+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description In vitro inhibition of matrix metalloprotease-13.				Bioorg Med Chem Lett 13: 3243-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q23ZMM
					More data for this Ligand-Target Pair