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BDBM50407807 CHEMBL2028841

SMILES: C[C@@H]1NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CC3CCCCC3N2C(=O)[C@H]2Cc3ccccc3CN2C1=O

InChI Key: InChIKey=UVXIBPIDZMHKGA-PCYKSRCGSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50407807   
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
Bradykinin B2 receptor


(Oryctolagus cuniculus)
BDBM50407807
PNG
(CHEMBL2028841)
Show SMILES C[C@@H]1NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]2CC3CCCCC3N2C(=O)[C@H]2Cc3ccccc3CN2C1=O |r|
Show InChI InChI=1S/C30H42N8O5/c1-17-28(42)37-16-20-9-3-2-7-18(20)13-24(37)29(43)38-22-11-5-4-8-19(22)14-23(38)27(41)36-21(10-6-12-33-30(31)32)26(40)34-15-25(39)35-17/h2-3,7,9,17,19,21-24H,4-6,8,10-16H2,1H3,(H,34,40)(H,35,39)(H,36,41)(H4,31,32,33)/t17-,19?,21-,22?,23-,24+/m0/s1
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 240n/an/an/an/an/a



Institute de Recherches Servier

Curated by ChEMBL


Assay Description
In vitro antagonistic activity against kinin-induced rabbit jugular vein contraction.


J Med Chem 39: 2095-101 (1996)


Article DOI: 10.1021/jm950682e
BindingDB Entry DOI: 10.7270/Q2PG1SXN
More data for this
Ligand-Target Pair