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BDBM50074042 3-[7-(4-Carbamimidoyl-benzoylamino)-3-oxo-1,2,3,5-tetrahydro-benzo[e][1,4]diazepin-4-yl]-propionic acid::CHEMBL356154

SMILES: NC(=N)c1ccc(cc1)C(=O)Nc1ccc2NCC(=O)N(CCC(O)=O)Cc2c1

InChI Key: InChIKey=VNECNMAMEWOPGM-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50074042   
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))
BDBM50074042
PNG
(3-[7-(4-Carbamimidoyl-benzoylamino)-3-oxo-1,2,3,5-...)
Show SMILES NC(=N)c1ccc(cc1)C(=O)Nc1ccc2NCC(=O)N(CCC(O)=O)Cc2c1
Show InChI InChI=1S/C20H21N5O4/c21-19(22)12-1-3-13(4-2-12)20(29)24-15-5-6-16-14(9-15)11-25(8-7-18(27)28)17(26)10-23-16/h1-6,9,23H,7-8,10-11H2,(H3,21,22)(H,24,29)(H,27,28)
PDB

KEGG

UniProtKB/SwissProt

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

Patents

Article
PubMed
290n/an/an/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Fibrinogen receptor binding affinity was determined by assaying for inhibition of [3H]-1 binding to purified Fibrinogen Receptor isolated from human...


J Med Chem 42: 545-59 (1999)


Article DOI: 10.1021/jm980166z
BindingDB Entry DOI: 10.7270/Q2QZ295H
More data for this
Ligand-Target Pair