Compound Detail
CHEMBL69271
NAXAGOLIDE 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL69271 |
| Name | NAXAGOLIDE |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | JCSREICEMHWFAY-HUUCEWRRSA-N |
4
Targets
6
Activities
2
Assay Types
0
PK Parameters
20
Publications
5
Known Names
Molecular Properties
247.3
MW (Da)
2.49
ALogP
3
HBA
1
HBD
32.7
PSA (Ų)
0.87
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Activity Summary
Ki 4 meas. best 9.7
IC50 2 meas. best 8.52
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| D(3) dopamine receptor CHEMBL234 | Ki | 9.7 | 9.69 | 0.2 | 2 |
| D(2) dopamine receptor CHEMBL339 | IC50 | 8.52 | 8.52 | 3.0 | 1 |
| D(2) dopamine receptor CHEMBL217 | Ki | 8.21 | 8.205 | 6.2 | 2 |
| Nucleic Acid CHEMBL345 | IC50 | 7.89 | 7.89 | 13.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| D(3) dopamine receptor | Ki | = | 0.1995 | nM | 9.7 | Agonistic activity at DRD3 receptor | 19635669 |
| D(3) dopamine receptor | Ki | = | 0.21 | nM | 9.68 | Tested for antagonist binding affinity by measuring displacement of [3H]spiperon... | 10956195 |
| D(2) dopamine receptor | IC50 | = | 3.0 | nM | 8.52 | Potency to displace the specific in vitro binding of [3H]DP-5,6-ADTN to rat stri... | 2903247 |
| D(2) dopamine receptor | Ki | = | 6.24 | nM | 8.21 | Human Dopamine receptor D2L affinities to determine agonist activity, using [3H]... | 10956195 |
| D(2) dopamine receptor | Ki | = | 6.31 | nM | 8.2 | Agonistic activity at DRD2 receptor | 19635669 |
| Nucleic Acid | IC50 | = | 13.0 | nM | 7.89 | Potency to displace the specific in vitro binding of [3H]N-0437 to calf striatal... | 2903247 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15646539 | 10.1016/s0399-8320(04)95062-2 | Unchecked | 11 |
| 15646539 | 10.1016/s0399-8320(04)95062-2 | NON-PROTEIN TARGET | 8 |
| 15943487 | 10.1021/jm050155n | Rattus norvegicus | 8 |
| 15943487 | 10.1021/jm050155n | Sodium-dependent dopamine transporter | 5 |
| 15943487 | 10.1021/jm050155n | Dopamine receptor D2 and D3 | 4 |
| 2903247 | 10.1021/jm00119a020 | Rattus norvegicus | 3 |
| 2903247 | 10.1021/jm00119a020 | No relevant target | 3 |
| 10956195 | 10.1021/jm0000113 | D(2) dopamine receptor | 2 |
| 15943487 | 10.1021/jm050155n | Unchecked | 2 |
| 15943487 | 10.1021/jm050155n | Alpha-2A adrenergic receptor | 2 |
| 15943487 | 10.1021/jm050155n | D(1A) dopamine receptor | 1 |
| 19635669 | 10.1016/j.bmcl.2009.07.055 | D(3) dopamine receptor | 1 |
| 19635669 | 10.1016/j.bmcl.2009.07.055 | D(2) dopamine receptor | 1 |
| 15943487 | 10.1021/jm050155n | Tyrosine 3-monooxygenase | 1 |
| 15943487 | 10.1021/jm050155n | Sigma non-opioid intracellular receptor 1 | 1 |
| 15943487 | 10.1021/jm050155n | Adrenergic receptor alpha-2 | 1 |
| 2903247 | 10.1021/jm00119a020 | D(2) dopamine receptor | 1 |
| 15943487 | 10.1021/jm050155n | 5-hydroxytryptamine receptor 1A | 1 |
| 10956195 | 10.1021/jm0000113 | D(4) dopamine receptor | 1 |
| 10956195 | 10.1021/jm0000113 | D(3) dopamine receptor | 1 |
Data from ChEMBL 36 via Core Engine