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SMILES: CCCCOC(=O)N[C@@H](CCC(=O)N1CCC2(CC(=O)N(C2=O)c2ccc(cc2)C(N)=N)CC1)C(O)=O

InChI Key: InChIKey=LVTBVIICWXMTGK-SFHVURJKSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50143873   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50143873
PNG
(2-Butoxycarbonylamino-5-[2-(4-carbamimidoyl-phenyl...)
Show SMILES CCCCOC(=O)N[C@@H](CCC(=O)N1CCC2(CC(=O)N(C2=O)c2ccc(cc2)C(N)=N)CC1)C(O)=O
Show InChI InChI=1S/C25H33N5O7/c1-2-3-14-37-24(36)28-18(22(33)34)8-9-19(31)29-12-10-25(11-13-29)15-20(32)30(23(25)35)17-6-4-16(5-7-17)21(26)27/h4-7,18H,2-3,8-15H2,1H3,(H3,26,27)(H,28,36)(H,33,34)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 30n/an/an/an/an/an/a



Millennium Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Tested for inhibition of the binding of fibrinogen to purified human GPIIb-IIIa in a 96-well format (ELISA assay)


J Med Chem 47: 2037-61 (2004)


Article DOI: 10.1021/jm030354b
BindingDB Entry DOI: 10.7270/Q2FQ9W1H
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50143873
PNG
(2-Butoxycarbonylamino-5-[2-(4-carbamimidoyl-phenyl...)
Show SMILES CCCCOC(=O)N[C@@H](CCC(=O)N1CCC2(CC(=O)N(C2=O)c2ccc(cc2)C(N)=N)CC1)C(O)=O
Show InChI InChI=1S/C25H33N5O7/c1-2-3-14-37-24(36)28-18(22(33)34)8-9-19(31)29-12-10-25(11-13-29)15-20(32)30(23(25)35)17-6-4-16(5-7-17)21(26)27/h4-7,18H,2-3,8-15H2,1H3,(H3,26,27)(H,28,36)(H,33,34)/t18-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 270n/an/an/an/an/an/a



Millennium Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Inhibition of platelet aggregation induced by 20 microM adenosine 5-diphosphate (ADP) in citrated human platelet rich plasma (h-PRP)


J Med Chem 47: 2037-61 (2004)


Article DOI: 10.1021/jm030354b
BindingDB Entry DOI: 10.7270/Q2FQ9W1H
More data for this
Ligand-Target Pair