BindingDB

null

SMILES NC(N)=S

InChI Key InChIKey=UMGDCJDMYOKAJW-UHFFFAOYSA-N

PDB links: 5 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50229993

Urease(Canavalia ensiformis (Jack bean) (Horse bean))
TBA

US Patent

BDBM50229993(2-thiourea | CHEMBL260876 | Thiocarbamid | Thiohar...)copy SMILEScopy InChI

Ki: 2.00E+4nM IC50: 2.10E+4nMpH: 6.8Assay Description:Reaction mixtures consisting of 25 μL (1 unit/well) of Jack bean (Canavalia ensiformis) urease, 55 μL of buffer at pH 6.8, 100 mM of urea, ...More data for this Ligand-Target Pair

PDB MMDB
UniProtKB/SwissProt
B.MOAD GoogleScholar

Purchase CHEMBL KEGG MMDB PC cid PC sid PDB Patents

Details
BindingDB Entry DOI: 10.7270/Q2XG9Q2TUS Patent

Alcohol dehydrogenase E/S chain(Equus caballus)
TBA

Curated by ChEMBL

BDBM50229993(2-thiourea | CHEMBL260876 | Thiocarbamid | Thiohar...)copy SMILEScopy InChI

Ki: 4.20E+7nMAssay Description:In vitro inhibition against horse liver alcohol dehydrogenaseMore data for this Ligand-Target Pair

PDB
UniProtKB/SwissProt
GoogleScholar

Purchase CHEMBL KEGG MMDB PC cid PC sid PDB Patents

Details
BindingDB Entry DOI: 10.7270/Q2PR7Z5WPubMed

Targets 7 ▿
- Urease 30
- Urease subunit alpha 2
- Serine-protein kinase ATM 1
- Alcohol dehydrogenase E/S chain 1
- Urease [D459Y,K653P] 1
- Serine/threonine-protein kinase ATR 1
- Urease subunit beta 1
Publications 29 ▿
- Eur J Med Chem 74: 314-23 (2014) 2
- Proc Natl Acad Sci USA 104: 20523-8 (2007) 2
- Eur J Med Chem 46: 5473-9 (2011) 2
- US Patent US9447057 (2016) 1
- Bioorg Chem 64: 85-96 (2016) 1
- Chem Biol Drug Des 87: 434-43 (2016) 1
- J Enzyme Inhib Med Chem 26: 480-4 (2011) 1
- Eur J Med Chem 87: 657-61 (2014) 1
- Eur J Med Chem 102: 464-70 (2015) 1
- J Enzyme Inhib Med Chem 25: 296-9 (2010) 1
- Bioorg Med Chem 26: 3791-3804 (2018) 1
- Bioorg Med Chem 26: 152-160 (2018) 1
- J Enzyme Inhib Med Chem 24: 437-46 (2009) 1
- Bioorg Med Chem 23: 7211-8 (2015) 1
- Bioorg Med Chem Lett 25: 3285-9 (2015) 1
- J Enzyme Inhib Med Chem 24: 151-6 (2009) 1
- J Enzyme Inhib Med Chem 25: 572-6 (2010) 1
- Eur J Med Chem 70: 487-96 (2013) 1
- Bioorg Chem 66: 80-7 (2016) 1
- Bioorg Chem 66: 111-6 (2016) 1
- J Enzyme Inhib Med Chem 28: 1316-23 (2013) 1
- J Med Chem 26: 916-22 (1983) 1
- Bioorg Chem 63: 123-31 (2015) 1
- Bioorg Med Chem 24: 4452-4463 (2016) 1
- Bioorg Med Chem Lett 27: 3014-3018 (2017) 1
- Bioorg Med Chem 23: 6049-58 (2015) 1
- Eur J Med Chem 69: 622-31 (2013) 1
- Chem Biol Drug Des 85: 225-30 (2015) 1
- Eur J Med Chem 67: 230-42 (2013) 1
Institutions 22 ▿
- [Quaid-i-Azam University] 5
- [COMSATS Institute of Information Technology] 3
- [TBA, University Karachi, Karadeniz Technical University, University of Oxford] 2
- [TBA, University Karachi, Karadeniz Technical University, University of Oxford] 2
- [TBA, University Karachi, Karadeniz Technical University, University of Oxford] 2
- [TBA, University Karachi, Karadeniz Technical University, University of Oxford] 2
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
- [Hazara University, The Islamia University of Bahawalpur, University of the Punjab, Solapur University, Khyber Medical College, Bahauddin Zakariya University, Universiti Teknologi MARA Puncak Alam Campus, Kongju National University, Universiti Teknologi MARA (UiTM), University of Mysore, University of Karachi, Department of Chemistry, Art and Science Faculty, Recep Tayyip Erdogan University, Rize, Turkey. Electronic address: emre.mentese@erdogan.edu.tr., Universiti Teknologi MARA (UiTM), Puncak Alam Campus, Imam Abdulrahman Bin Faisal University, University of Peshawar, Quaid-I-Azam University] 1
Affinity: 2.0E+2 to 4.2E+7 nM▿
- Ki 6
- IC50 33
- Affinity ≤ nM
Xtal structures: 0
Docked structures: 0
Catalog Cmpds: 1