Ki Summary

Reaction Details

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Target

B1 bradykinin receptor

Ligand

BDBM50381277

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_814368 (CHEMBL2019577)

4.3±n/a nM

Citation

Eles, J; Beke, G; Vágó, I; Bozó, E; Huszár, J; Tarcsay, A; Kolok, S; Schmidt, E; Vastag, M; Hornok, K; Farkas, S; Domány, G; Keseru, GM Quinolinyl- and phenantridinyl-acetamides as bradykinin B1 receptor antagonists. Bioorg Med Chem Lett22:3095-9 (2012) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

B1 bradykinin receptor

Name:

B1 bradykinin receptor

Synonyms:

Type:

Enzyme

Mol. Mass.:

40508.87

Organism:

Homo sapiens (Human)

Description:

P46663

Residue:

353

Sequence:

MASSWPPLELQSSNQSQLFPQNATACDNAPEAWDLLHRVLPTFIISICFFGLLGNLFVLL
VFLLPRRQLNVAEIYLANLAASDLVFVLGLPFWAENIWNQFNWPFGALLCRVINGVIKAN
LFISIFLVVAISQDRYRVLVHPMASRRQQRRRQARVTCVLIWVVGGLLSIPTFLLRSIQA
VPDLNITACILLLPHEAWHFARIVELNILGFLLPLAAIVFFNYHILASLRTREEVSRTRC
GGRKDSKTTALILTLVVAFLVCWAPYHFFAFLEFLFQVQAVRGCFWEDFIDLGLQLANFF
AFTNSSLNPVIYVFVGRLFRTKVWELYKQCTPKSLAPISSSHRKEIFQLFWRN

BDBM50381277

n/a

Name

BDBM50381277

Synonyms:

CHEMBL2018863

Type

Small organic molecule

Emp. Form.

C28H34Cl2N4O3S

Mol. Mass.

577.566

SMILES

Clc1ccc(cc1Cl)S(=O)(=O)N1C(CC(=O)N[C@H]2CC[C@H](CCC3=NCCN3)CC2)CCc2ccccc12 |r,wU:17.17,wD:20.21,t:24,(-10.44,-4.97,;-9.11,-4.2,;-7.77,-4.96,;-6.44,-4.19,;-6.45,-2.65,;-7.79,-1.88,;-9.12,-2.66,;-10.45,-1.89,;-5.12,-1.88,;-3.64,-1.47,;-4.04,-2.97,;-5.13,-.34,;-3.79,.44,;-2.45,-.33,;-1.12,.44,;-1.13,1.98,;.21,-.32,;1.55,.45,;1.53,1.99,;2.87,2.76,;4.2,1.99,;5.54,2.76,;6.87,1.98,;8.1,2.92,;8.07,4.47,;9.52,4.97,;10.45,3.75,;9.57,2.48,;4.2,.45,;2.87,-.32,;-3.8,1.98,;-5.14,2.75,;-6.47,1.97,;-7.8,2.73,;-9.13,1.96,;-9.13,.42,;-7.8,-.35,;-6.46,.42,)|

Structure