Ki Summary

Reaction Details

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Target

C-X-C chemokine receptor type 3

Ligand

BDBM166459

Substrate/Competitor

n/a

Meas. Tech.

Competition Radioligand Binding Assay

IC50

64±n/a nM

Citation

Bata, I; Buzder-Lantos, P; Vasas, A; Bartane Bodor, V; Ferenczy, G; Tomoskozi, Z; Szeleczky, G; Batori, S; Smrcina, M; Patek, M; Weichsel, A; Thorpe, DS Cycloalkane carboxylic acid derivatives as CXCR3 receptor antagonists US Patent US9073853 Publication Date 7/7/2015

More Info.:

Get all data from this article, Assay Method

C-X-C chemokine receptor type 3

Name:

C-X-C chemokine receptor type 3

Synonyms:

Type:

Enzyme Catalytic Domain

Mol. Mass.:

40665.65

Organism:

Homo sapiens (Human)

Description:

n/a

Residue:

368

Sequence:

MVLEVSDHQVLNDAEVAALLENFSSSYDYGENESDSCCTSPPCPQDFSLNFDRAFLPALY
SLLFLLGLLGNGAVAAVLLSRRTALSSTDTFLLHLAVADTLLVLTLPLWAVDAAVQWVFG
SGLCKVAGALFNINFYAGALLLACISFDRYLNIVHATQLYRRGPPARVTLTCLAVWGLCL
LFALPDFIFLSAHHDERLNATHCQYNFPQVGRTALRVLQLVAGFLLPLLVMAYCYAHILA
VLLVSRGQRRLRAMRLVVVVVVAFALCWTPYHLVVLVDILMDLGALARNCGRESRVDVAK
SVTSGLGYMHCCLNPLLYAFVGVKFRERMWMLLLRLGCPNQRGLQRQPSSSRRDSSWSET
SEASYSGL

BDBM166459

n/a

Name

BDBM166459

Synonyms:

US9073853, 18

Type

Small organic molecule

Emp. Form.

C33H42N2O7

Mol. Mass.

578.6958

SMILES

CCC(N(C[C@H]1CC[C@@H](CC1)C(O)=O)Cc1ccc(OCCN2C(=O)CCC2=O)c(OC)c1)c1ccc2OCCc2c1 |r,wU:5.4,wD:8.11,(-5.33,-5.23,;-4,-4.46,;-4,-2.92,;-2.67,-2.15,;-2.67,-.61,;-1.58,.48,;-1.98,1.96,;-.89,3.05,;.6,2.66,;1,1.17,;-.09,.08,;1.69,3.74,;1.29,5.23,;3.18,3.35,;-1.33,-2.92,;,-2.15,;,-.61,;1.33,.16,;2.67,-.61,;4,.16,;5.33,-.61,;6.67,.16,;8,-.61,;8,-2.15,;6.67,-2.92,;9.47,-2.63,;10.37,-1.38,;9.47,-.14,;9.87,1.35,;2.67,-2.15,;4,-2.92,;5.33,-2.15,;1.33,-2.92,;-5.33,-2.15,;-5.33,-.61,;-6.67,.16,;-8,-.61,;-9.47,-.14,;-10.37,-1.38,;-9.47,-2.63,;-8,-2.15,;-6.67,-2.92,)|

Structure