Ki Summary

Reaction Details

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Target

C-C chemokine receptor type 1

Ligand

BDBM50098639

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_218695 (CHEMBL821481)

IC50

1300±n/a nM

Citation

Naya, A; Sagara, Y; Ohwaki, K; Saeki, T; Ichikawa, D; Iwasawa, Y; Noguchi, K; Ohtake, N Design, synthesis, and discovery of a novel CCR1 antagonist. J Med Chem44:1429-35 (2001) [PubMed]

More Info.:

Get all data from this article, Assay Method

C-C chemokine receptor type 1

Name:

C-C chemokine receptor type 1

Synonyms:

Type:

PROTEIN

Mol. Mass.:

40904.59

Organism:

Mus musculus

Description:

ChEMBL_1452291

Residue:

355

Sequence:

MEISDFTEAYPTTTEFDYGDSTPCQKTAVRAFGAGLLPPLYSLVFIIGVVGNVLVILVLM
QHRRLQSMTSIYLFNLAVSDLVFLFTLPFWIDYKLKDDWIFGDAMCKLLSGFYYLGLYSE
IFFIILLTIDRYLAIVHAVFALRARTVTFGIITSIITWALAILASMPALYFFKAQWEFTH
RTCSPHFPYKSLKQWKRFQALKLNLLGLILPLLVMIICYAGIIRILLRRPSEKKVKAVRL
IFAITLLFFLLWTPYNLSVFVSAFQDVLFTNQCEQSKQLDLAMQVTEVIAYTHCCVNPII
YVFVGERFWKYLRQLFQRHVAIPLAKWLPFLSVDQLERTSSISPSTGEHELSAGF

BDBM50098639

n/a

Name

BDBM50098639

Synonyms:

1-Benzyl-1-cyclooctylmethyl-4-[(9H-xanthene-9-carbonyl)-amino]-piperidinium; bromide | CHEMBL33586

Type

Small organic molecule

Emp. Form.

C35H43N2O2

Mol. Mass.

523.7276

SMILES

O=C(NC1CC[N+](CC2CCCCCCC2)(Cc2ccccc2)CC1)C1c2ccccc2Oc2ccccc12 |(-5.83,-6.9,;-5.8,-8.44,;-4.48,-9.21,;-3.16,-8.42,;-1.82,-9.18,;-.47,-8.42,;-.5,-6.88,;.84,-7.65,;2.41,-6.94,;1.81,-5.53,;2.41,-4.11,;3.83,-3.51,;5.24,-4.11,;5.84,-5.53,;5.24,-6.94,;3.83,-7.54,;-.51,-5.32,;-1.86,-4.57,;-1.88,-3.03,;-3.23,-2.29,;-4.54,-3.08,;-4.51,-4.63,;-3.18,-5.37,;-1.85,-6.13,;-3.16,-6.88,;-7.14,-9.21,;-8.46,-8.44,;-8.46,-6.9,;-9.8,-6.13,;-11.15,-6.9,;-11.12,-8.45,;-9.8,-9.21,;-9.8,-10.75,;-8.49,-11.52,;-8.49,-13.03,;-7.17,-13.8,;-5.83,-13.06,;-5.83,-11.53,;-7.14,-10.75,)|

Structure