General
Preferred name
CAY10471
Synonyms
TM30089 Racemate ()
CAY 10471 ()
CAY10471 (Racemate) ()
TM30089 (Racemate) ()
CAY10471 Racemate ()
TM30089 ()
[18F]TM30089 ()
P&D ID
PD020390
CAS
844639-57-2
627865-18-3
Tags
drug candidate
available
Drug indication
Allergy
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
TM30089 (CAY 10471) is a selective, insurmountable DP2 receptor antagonist that reduces orthosteric ligand (PGD2) binding capacity (Bmax) without affecting PGD2 affinity . It is a analogue. We represent the structure without specified stereochemistry.
(GtoPdb)
DESCRIPTION
CAY10471 Racemate (TM30089 Racemate) is a potent and highly selective prostaglandin D2 receptor CRTH2 antagonist, with a Ki of 0.6 nM for hCRTH2, selective over human thromboxane A2 receptor TP (Ki, >10000 nM) or PGD2 receptor DP (Ki, 1200 nM). CAY10471 Racemate also has effect on mouse and rat orthologs of CRTH2[1].
PRICE
59
DESCRIPTION
This is a fluorine-18 radio-labelled tracer of the DP2 receptor antagonist .
(GtoPdb)
DESCRIPTION
CAY10471 is an analog of BAY-u3405, which contains modifications that increase both its potency and selectivity for the human CRTH2/DP2 receptor. CAY10471 binds to the human DP1 with Ki of 1200 nM and DP2 with Ki of 0.6 nM. It also show very high binding affinity with TP, which Ki can higher than 10,000 nM.
(BOC Sciences Bioactive Compounds)
DESCRIPTION
CAY10471 Racemate (TM30089 Racemate) is a potent and highly selective CRTH2/DP2 receptor antagonist. It binds to human CRTH2/DP2, DP1, and TP receptors with Ki values of 0.6, 1200, and >10,000 nM, respectively.
(TargetMol Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
11
BOC Sciences Bioactive Compounds
Cayman Chemical Bioactives
Concise Guide to Pharmacology 2017/18
Concise Guide to Pharmacology 2019/20
Concise Guide to Pharmacology 2021/22
Concise Guide to Pharmacology 2023/24
DrugMAP
EUbOPEN Chemogenomics Library
MedChem Express Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
17
Molecular Weight
416.12
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
1
Rotatable Bonds
5
Ring Count
4
Aromatic Ring Count
3
cLogP
3.04
TPSA
79.61
Fraction CSP3
0.29
Chiral centers
1.0
Largest ring
6.0
QED
0.69
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
CRTh2 (DP2) receptor
Prostaglandin Receptor
Pathway
Endocrinology/Hormones
GPCR/G protein
Immunology/Inflammation
Solubility
Soluble in water (0.5 mg/ml at 25.0° C), ethanol (15 mg/ml), DMSO (30 mg/ml), DMF (30 mg/ml), and 1: 5 DMSO: PBS (pH 7.2, ~0.5 mg/ml).
Recommended Cell Concentration
None
Source data
