BDBM50301109 (5S,6S)-5-(hydroxycarbamoyl)-6-(4-phenylpiperazine-1-carbonyl)piperidin-3-yl pyrrolidine-1-carboxylate::CHEMBL566233

SMILES: ONC(=O)[C@H]1C[C@@H](CN[C@@H]1C(=O)N1CCN(CC1)c1ccccc1)OC(=O)N1CCCC1

InChI Key: InChIKey=YLTJCMLZAIRVFF-FHWLQOOXSA-N

Data: 6 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 6 hits for monomerid = 50301109   

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))	BDBM50301109 ((5S,6S)-5-(hydroxycarbamoyl)-6-(4-phenylpiperazine...) Show SMILES ONC(=O)[C@H]1C[C@@H](CN[C@@H]1C(=O)N1CCN(CC1)c1ccccc1)OC(=O)N1CCCC1 |r| Show InChI InChI=1S/C22H31N5O5/c28-20(24-31)18-14-17(32-22(30)27-8-4-5-9-27)15-23-19(18)21(29)26-12-10-25(11-13-26)16-6-2-1-3-7-16/h1-3,6-7,17-19,23,31H,4-5,8-15H2,(H,24,28)/t17-,18-,19-/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 PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Incyte Corporation Curated by ChEMBL					Assay Description Inhibition of MMP-2				Bioorg Med Chem Lett 19: 5037-42 (2009) Article DOI: 10.1016/j.bmcl.2009.07.052 BindingDB Entry DOI: 10.7270/Q2154J0S
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 10 (ADAM10) (Homo sapiens (Human))	BDBM50301109 ((5S,6S)-5-(hydroxycarbamoyl)-6-(4-phenylpiperazine...) Show SMILES ONC(=O)[C@H]1C[C@@H](CN[C@@H]1C(=O)N1CCN(CC1)c1ccccc1)OC(=O)N1CCCC1 |r| Show InChI InChI=1S/C22H31N5O5/c28-20(24-31)18-14-17(32-22(30)27-8-4-5-9-27)15-23-19(18)21(29)26-12-10-25(11-13-26)16-6-2-1-3-7-16/h1-3,6-7,17-19,23,31H,4-5,8-15H2,(H,24,28)/t17-,18-,19-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Incyte Corporation Curated by ChEMBL					Assay Description Inhibition of ADAM-10				Bioorg Med Chem Lett 19: 5037-42 (2009) Article DOI: 10.1016/j.bmcl.2009.07.052 BindingDB Entry DOI: 10.7270/Q2154J0S
					More data for this Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50301109 ((5S,6S)-5-(hydroxycarbamoyl)-6-(4-phenylpiperazine...) Show SMILES ONC(=O)[C@H]1C[C@@H](CN[C@@H]1C(=O)N1CCN(CC1)c1ccccc1)OC(=O)N1CCCC1 |r| Show InChI InChI=1S/C22H31N5O5/c28-20(24-31)18-14-17(32-22(30)27-8-4-5-9-27)15-23-19(18)21(29)26-12-10-25(11-13-26)16-6-2-1-3-7-16/h1-3,6-7,17-19,23,31H,4-5,8-15H2,(H,24,28)/t17-,18-,19-/m0/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
Incyte Corporation Curated by ChEMBL					Assay Description Inhibition of HER-2				Bioorg Med Chem Lett 19: 5037-42 (2009) Article DOI: 10.1016/j.bmcl.2009.07.052 BindingDB Entry DOI: 10.7270/Q2154J0S
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50301109 ((5S,6S)-5-(hydroxycarbamoyl)-6-(4-phenylpiperazine...) Show SMILES ONC(=O)[C@H]1C[C@@H](CN[C@@H]1C(=O)N1CCN(CC1)c1ccccc1)OC(=O)N1CCCC1 |r| Show InChI InChI=1S/C22H31N5O5/c28-20(24-31)18-14-17(32-22(30)27-8-4-5-9-27)15-23-19(18)21(29)26-12-10-25(11-13-26)16-6-2-1-3-7-16/h1-3,6-7,17-19,23,31H,4-5,8-15H2,(H,24,28)/t17-,18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Incyte Corporation Curated by ChEMBL					Assay Description Inhibition of MMP-3				Bioorg Med Chem Lett 19: 5037-42 (2009) Article DOI: 10.1016/j.bmcl.2009.07.052 BindingDB Entry DOI: 10.7270/Q2154J0S
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50301109 ((5S,6S)-5-(hydroxycarbamoyl)-6-(4-phenylpiperazine...) Show SMILES ONC(=O)[C@H]1C[C@@H](CN[C@@H]1C(=O)N1CCN(CC1)c1ccccc1)OC(=O)N1CCCC1 |r| Show InChI InChI=1S/C22H31N5O5/c28-20(24-31)18-14-17(32-22(30)27-8-4-5-9-27)15-23-19(18)21(29)26-12-10-25(11-13-26)16-6-2-1-3-7-16/h1-3,6-7,17-19,23,31H,4-5,8-15H2,(H,24,28)/t17-,18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Incyte Corporation Curated by ChEMBL					Assay Description Inhibition of MMP-9				Bioorg Med Chem Lett 19: 5037-42 (2009) Article DOI: 10.1016/j.bmcl.2009.07.052 BindingDB Entry DOI: 10.7270/Q2154J0S
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50301109 ((5S,6S)-5-(hydroxycarbamoyl)-6-(4-phenylpiperazine...) Show SMILES ONC(=O)[C@H]1C[C@@H](CN[C@@H]1C(=O)N1CCN(CC1)c1ccccc1)OC(=O)N1CCCC1 |r| Show InChI InChI=1S/C22H31N5O5/c28-20(24-31)18-14-17(32-22(30)27-8-4-5-9-27)15-23-19(18)21(29)26-12-10-25(11-13-26)16-6-2-1-3-7-16/h1-3,6-7,17-19,23,31H,4-5,8-15H2,(H,24,28)/t17-,18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Incyte Corporation Curated by ChEMBL					Assay Description Inhibition of MMP-1				Bioorg Med Chem Lett 19: 5037-42 (2009) Article DOI: 10.1016/j.bmcl.2009.07.052 BindingDB Entry DOI: 10.7270/Q2154J0S
					More data for this Ligand-Target Pair