BindingDB

null

SMILES [#6]-[#6](-[#6])-[#6@@H]-1-[#7]-[#6](=O)-[#6@@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6]-1=O

InChI Key InChIKey=YYQUWEHEBOMRPH-NYUBLWNDSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50237601

Integrin alpha-IIb/beta-3(Homo sapiens (Human))
University of Hamburg

Curated by ChEMBL

BDBM50237601(CHEMBL411941 | CycloRGDfV | [(2S,5R,8S,11S)-5-Benz...)copy SMILEScopy InChI

IC50: 1.20E+4nMAssay Description:Inhibition of integrin alphaIIb-beta3 bindingMore data for this Ligand-Target Pair

PDB KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details
BindingDB Entry DOI: 10.7270/Q24T6K3SPubMed

Integrin alpha-IIb/beta-3(Homo sapiens (Human))
University of Hamburg

Curated by ChEMBL

BDBM50237601(CHEMBL411941 | CycloRGDfV | [(2S,5R,8S,11S)-5-Benz...)copy SMILEScopy InChI

IC50: 1.00E+5nMAssay Description:Inhibition of human platelet aggregation mediated by alpha llb/beta3 interaction with fibrinogenMore data for this Ligand-Target Pair

PDB KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article
BindingDB Entry DOI: 10.7270/Q2X06885PubMed

Integrin alpha-IIb/beta-3(Homo sapiens (Human))
University of Hamburg

Curated by ChEMBL

BDBM50237601(CHEMBL411941 | CycloRGDfV | [(2S,5R,8S,11S)-5-Benz...)copy SMILEScopy InChI

IC50: 1.00E+3nMAssay Description:Inhibition of fibrinogen binding to alpha2bbeta3 isolated from human HEL cells incubated for 1 hr by scintillation-proximity assay based competitive ...More data for this Ligand-Target Pair

PDB KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details
BindingDB Entry DOI: 10.7270/Q2154MPKPubMed

Targets 5 ▿
- Integrin alpha-V/beta-3 16
- Integrin alpha-V/beta-5 6
- Integrin alpha-IIb/beta-3 3
- Integrin alpha-5/beta-1 2
- Integrin alpha-V/beta-6 2
Publications 14 ▿
- J Med Chem 53: 106-18 (2010) 3
- ACS Med Chem Lett 9: 6-10 (2018) 2
- J Med Chem 49: 1808-17 (2006) 2
- J Med Chem 48: 7675-87 (2005) 2
- Bioorg Med Chem 16: 4262-71 (2008) 2
- J Med Chem 39: 4520-6 (1996) 2
- J Med Chem 55: 10460-74 (2012) 2
- J Med Chem 44: 3059-65 (2001) 1
- J Med Chem 60: 248-262 (2017) 1
- Bioorg Med Chem Lett 16: 6178-80 (2006) 1
- Bioorg Med Chem Lett 21: 2116-20 (2011) 1
- J Med Chem 62: 7417-7430 (2019) 1
- Bioorg Med Chem Lett 16: 5878-82 (2006) 1
- Eur J Med Chem 83: 284-93 (2014) 1
Institutions 14 ▿
- [Universita degli Studi di Bologna] 3
- [Universit£ di Parma, Tokyo Medical and Dental University, Universit£ degli Studi di Milano, Istituto di Ricerche Chimiche e Biochimiche G. Ronzoni, Department of Organic Chemistry Ugo Schiff University of Firenze via della Lastruccia 13, Texas A& M University] 2
- [Universit£ di Parma, Tokyo Medical and Dental University, Universit£ degli Studi di Milano, Istituto di Ricerche Chimiche e Biochimiche G. Ronzoni, Department of Organic Chemistry Ugo Schiff University of Firenze via della Lastruccia 13, Texas A& M University] 2
- [Universit£ di Parma, Tokyo Medical and Dental University, Universit£ degli Studi di Milano, Istituto di Ricerche Chimiche e Biochimiche G. Ronzoni, Department of Organic Chemistry Ugo Schiff University of Firenze via della Lastruccia 13, Texas A& M University] 2
- [Universit£ di Parma, Tokyo Medical and Dental University, Universit£ degli Studi di Milano, Istituto di Ricerche Chimiche e Biochimiche G. Ronzoni, Department of Organic Chemistry Ugo Schiff University of Firenze via della Lastruccia 13, Texas A& M University] 2
- [Universit£ di Parma, Tokyo Medical and Dental University, Universit£ degli Studi di Milano, Istituto di Ricerche Chimiche e Biochimiche G. Ronzoni, Department of Organic Chemistry Ugo Schiff University of Firenze via della Lastruccia 13, Texas A& M University] 2
- [Universit£ di Parma, Tokyo Medical and Dental University, Universit£ degli Studi di Milano, Istituto di Ricerche Chimiche e Biochimiche G. Ronzoni, Department of Organic Chemistry Ugo Schiff University of Firenze via della Lastruccia 13, Texas A& M University] 2
- [Universit£ degli Studi di Parma , Chinese Academy of Sciences, Bielefeld University, Chinese Academy of Medical Sciences and Peking Union Medical College, Washington University School of Medicine, University of Hamburg, University of Bologna] 1
- [Universit£ degli Studi di Parma , Chinese Academy of Sciences, Bielefeld University, Chinese Academy of Medical Sciences and Peking Union Medical College, Washington University School of Medicine, University of Hamburg, University of Bologna] 1
- [Universit£ degli Studi di Parma , Chinese Academy of Sciences, Bielefeld University, Chinese Academy of Medical Sciences and Peking Union Medical College, Washington University School of Medicine, University of Hamburg, University of Bologna] 1
- [Universit£ degli Studi di Parma , Chinese Academy of Sciences, Bielefeld University, Chinese Academy of Medical Sciences and Peking Union Medical College, Washington University School of Medicine, University of Hamburg, University of Bologna] 1
- [Universit£ degli Studi di Parma , Chinese Academy of Sciences, Bielefeld University, Chinese Academy of Medical Sciences and Peking Union Medical College, Washington University School of Medicine, University of Hamburg, University of Bologna] 1
- [Universit£ degli Studi di Parma , Chinese Academy of Sciences, Bielefeld University, Chinese Academy of Medical Sciences and Peking Union Medical College, Washington University School of Medicine, University of Hamburg, University of Bologna] 1
- [Universit£ degli Studi di Parma , Chinese Academy of Sciences, Bielefeld University, Chinese Academy of Medical Sciences and Peking Union Medical College, Washington University School of Medicine, University of Hamburg, University of Bologna] 1
Affinity: 0.11 to 1.0E+5 nM▿
- IC50 29
- Affinity ≤ nM
Xtal structures: 0
Docked structures: 0
Catalog Cmpds: 0