BDBM50089084 CHEMBL3317857::Vaborbactam
SMILES: OB1O[C@H](CC(O)=O)CC[C@@H]1NC(=O)Cc1cccs1
InChI Key: InChIKey=IOOWNWLVCOUUEX-WPRPVWTQSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
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Carbapenem-hydrolyzing beta-lactamase KPC () | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | PDB Article PubMed | 56 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Qpex Biopharma, Inc. Curated by ChEMBL | Assay Description Inhibition of recombinant Escherichia coli KPC-2 using nitrocefin as substrate preincubated for 10 mins followed by substrate addition and measured e... | J Med Chem 63: 7491-7507 (2020) Article DOI: 10.1021/acs.jmedchem.9b01976 | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) | ||||||||||||
Beta-lactamase VIM-1 (Klebsiella pneumoniae) | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB UniProtKB/TrEMBL GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | Article PubMed | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Qpex Biopharma, Inc. Curated by ChEMBL | Assay Description Inhibition of recombinant Escherichia coli VIM-1 using nitrocefin as substrate preincubated for 10 mins followed by substrate addition measured every... | J Med Chem 63: 7491-7507 (2020) Article DOI: 10.1021/acs.jmedchem.9b01976 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Beta-lactamase OXA-23 (Acinetobacter baumannii) | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | Article PubMed | >4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Qpex Biopharma, Inc. Curated by ChEMBL | Assay Description Inhibition of Acinetobacter baumannii OXA-23 using nitrocefin as substrate preincubated for 10 mins followed by substrate addition measured every 10 ... | J Med Chem 63: 7491-7507 (2020) Article DOI: 10.1021/acs.jmedchem.9b01976 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Urokinase-type plasminogen activator (Homo sapiens (Human)) | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | Article PubMed | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Rempex Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of urokinase (unknown origin) using NGK-pNA as substrate preincubated for 10 mins followed by substrate addition measured for 30 mins by s... | J Med Chem 58: 3682-92 (2015) Article DOI: 10.1021/acs.jmedchem.5b00127 BindingDB Entry DOI: 10.7270/Q2765H2V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Tissue-type plasminogen activator (Homo sapiens (Human)) | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | Article PubMed | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Rempex Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of tissue plasminogen activator (unknown origin) using GK-pNA as substrate preincubated for 10 mins followed by substrate addition measure... | J Med Chem 58: 3682-92 (2015) Article DOI: 10.1021/acs.jmedchem.5b00127 BindingDB Entry DOI: 10.7270/Q2765H2V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dipeptidyl peptidase 2 (DPP II) (Homo sapiens (Human)) | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | Article PubMed | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Rempex Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of dipeptidyl peptidase 7 (unknown origin) using H-Lys-Pro-AMC as substrate preincubated for 10 mins followed by substrate addition measur... | J Med Chem 58: 3682-92 (2015) Article DOI: 10.1021/acs.jmedchem.5b00127 BindingDB Entry DOI: 10.7270/Q2765H2V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Leukocyte elastase (Homo sapiens (Human)) | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | Article PubMed | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Rempex Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of neutrophil elastase (unknown origin) using MeOSuc-AAVP-AMC as substrate preincubated for 10 mins followed by substrate addition measure... | J Med Chem 58: 3682-92 (2015) Article DOI: 10.1021/acs.jmedchem.5b00127 BindingDB Entry DOI: 10.7270/Q2765H2V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cathepsin A (CTSA) (Homo sapiens (Human)) | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | Article PubMed | n/a | n/a | 1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Rempex Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of cathepsin A (unknown origin) using MCA-RPPGFSAFK-Dnp as substrate preincubated for 10 mins followed by substrate addition measured for ... | J Med Chem 58: 3682-92 (2015) Article DOI: 10.1021/acs.jmedchem.5b00127 BindingDB Entry DOI: 10.7270/Q2765H2V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Prothrombin (Homo sapiens (Human)) | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB Reactome pathway UniProtKB/SwissProt antibodypedia GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | Article PubMed | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Rempex Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of thrombin (unknown origin) using Benz-FVR-AMC as substrate preincubated for 10 mins followed by substrate addition measured for 30 mins ... | J Med Chem 58: 3682-92 (2015) Article DOI: 10.1021/acs.jmedchem.5b00127 BindingDB Entry DOI: 10.7270/Q2765H2V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Plasminogen (Homo sapiens (Human)) | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | Article PubMed | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Rempex Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of plasmin (unknown origin) using H-D-VLK-pNA as substrate preincubated for 10 mins followed by substrate addition measured for 30 mins by... | J Med Chem 58: 3682-92 (2015) Article DOI: 10.1021/acs.jmedchem.5b00127 BindingDB Entry DOI: 10.7270/Q2765H2V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Trypsin (Homo sapiens (Human)) | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | Article PubMed | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Rempex Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of trypsin (unknown origin) using N-Bz-R-AMC as substrate preincubated for 10 mins followed by substrate addition measured for 30 mins by ... | J Med Chem 58: 3682-92 (2015) Article DOI: 10.1021/acs.jmedchem.5b00127 BindingDB Entry DOI: 10.7270/Q2765H2V | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Chymase (Homo sapiens (Human)) | BDBM50089084![]() (CHEMBL3317857 | Vaborbactam) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar | Purchase CHEMBL PC cid PC sid PDB UniChem Patents | Article PubMed | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Rempex Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of chymase (unknown origin) using Suc-AAPF-AMC as substrate preincubated for 10 mins followed by substrate addition measured for 30 mins b... | J Med Chem 58: 3682-92 (2015) Article DOI: 10.1021/acs.jmedchem.5b00127 BindingDB Entry DOI: 10.7270/Q2765H2V | |||||||||||
More data for this Ligand-Target Pair |