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BDBM50004341 3-(8-Guanidino-octanoylamino)-N-[2-phenyl-1-(5H-tetrazol-5-yl)-ethyl]-succinamic acid::CHEMBL343183

SMILES: NC(=[NH2+])NCCCCCCCC(=O)N[C@@H](CC([O-])=O)C(=O)N[C@@H](Cc1ccccc1)c1nnn[nH]1

InChI Key: InChIKey=YRUSFCAYUXAHRN-IRXDYDNUSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50004341   
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))
BDBM50004341
PNG
(3-(8-Guanidino-octanoylamino)-N-[2-phenyl-1-(5H-te...)
Show SMILES NC(=[NH2+])NCCCCCCCC(=O)N[C@@H](CC([O-])=O)C(=O)N[C@@H](Cc1ccccc1)c1nnn[nH]1
Show InChI InChI=1S/C22H33N9O4/c23-22(24)25-12-8-3-1-2-7-11-18(32)26-17(14-19(33)34)21(35)27-16(20-28-30-31-29-20)13-15-9-5-4-6-10-15/h4-6,9-10,16-17H,1-3,7-8,11-14H2,(H,26,32)(H,27,35)(H,33,34)(H4,23,24,25)(H,28,29,30,31)/t16-,17-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Searle Research& Development

Curated by ChEMBL


Assay Description
Inhibition of 125 I-Fibrinogen binding to Fibrinogen receptor


J Med Chem 35: 4914-7 (1993)


Article DOI: 10.1021/jm00104a019
BindingDB Entry DOI: 10.7270/Q2319WHS
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50004341
PNG
(3-(8-Guanidino-octanoylamino)-N-[2-phenyl-1-(5H-te...)
Show SMILES NC(=[NH2+])NCCCCCCCC(=O)N[C@@H](CC([O-])=O)C(=O)N[C@@H](Cc1ccccc1)c1nnn[nH]1
Show InChI InChI=1S/C22H33N9O4/c23-22(24)25-12-8-3-1-2-7-11-18(32)26-17(14-19(33)34)21(35)27-16(20-28-30-31-29-20)13-15-9-5-4-6-10-15/h4-6,9-10,16-17H,1-3,7-8,11-14H2,(H,26,32)(H,27,35)(H,33,34)(H4,23,24,25)(H,28,29,30,31)/t16-,17-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.00E+3n/an/an/an/an/an/a



Searle Research& Development

Curated by ChEMBL


Assay Description
Inhibition of platelet aggregation (PRP)


J Med Chem 35: 4914-7 (1993)


Article DOI: 10.1021/jm00104a019
BindingDB Entry DOI: 10.7270/Q2319WHS
More data for this
Ligand-Target Pair