Compound Detail
CHEMBL63756
FLUPERLAPINE 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL63756 |
| Name | FLUPERLAPINE |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | OBWGMKKHCLHVIE-UHFFFAOYSA-N |
4
Targets
8
Activities
1
Assay Types
0
PK Parameters
20
Publications
4
Known Names
Molecular Properties
309.4
MW (Da)
3.06
ALogP
3
HBA
0
HBD
18.8
PSA (Ų)
0.74
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Achiral |
Activity Summary
Ki 8 meas. best 8.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Serotonin 2 (5-HT2) receptor CHEMBL2093870 | Ki | 8.42 | 8.415 | 3.8 | 2 |
| Muscarinic acetylcholine receptor CHEMBL1907609 | Ki | 7.6 | 7.6 | 25.0 | 2 |
| D(2) dopamine receptor CHEMBL339 | Ki | 6.88 | 6.88 | 131.8 | 2 |
| D(1A) dopamine receptor CHEMBL265 | Ki | 6.85 | 6.85 | 141.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Serotonin 2 (5-HT2) receptor | Ki | = | 3.8 | nM | 8.42 | In vitro binding affinity against rat 5-hydroxytryptamine 2 receptor. | 8101877 |
| Serotonin 2 (5-HT2) receptor | Ki | = | 3.89 | nM | 8.41 | Binding affinity against serotonin 5-hydroxytryptamine 2 receptor | 7907148 |
| Muscarinic acetylcholine receptor | Ki | = | 25.0 | nM | 7.6 | In vitro binding affinity against Muscarinic acetylcholine receptors in rat brai... | 8101877 |
| Muscarinic acetylcholine receptor | Ki | = | 25.12 | nM | 7.6 | Binding affinity against muscarinic (M) receptor | 7907148 |
| D(2) dopamine receptor | Ki | = | 133.0 | nM | 6.88 | In vitro binding affinity against Dopamine D2 receptor in rat striatal tissue. | 8101877 |
| D(2) dopamine receptor | Ki | = | 131.83 | nM | 6.88 | Binding affinity against dopamine D2 receptor | 7907148 |
| D(1A) dopamine receptor | Ki | = | 141.0 | nM | 6.85 | In vitro binding affinity against Dopamine receptor D1 in rat striatal tissue | 8101877 |
| D(1A) dopamine receptor | Ki | = | 141.25 | nM | 6.85 | Binding affinity against dopamine receptor D1 | 7907148 |
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 |
| - | 10.6019/CHEMBL4651402 | SARS-CoV-2 | 2 |
| 7907148 | 10.1021/jm00030a011 | Muscarinic acetylcholine receptor | 1 |
| - | 10.6019/CHEMBL4513141 | Escherichia coli | 1 |
| - | 10.6019/CHEMBL4513141 | Cryptococcus neoformans | 1 |
| - | 10.6019/CHEMBL4513141 | Candida albicans | 1 |
| 20806939 | 10.1021/jm100477n | Transient receptor potential cation channel subfamily A member 1 | 1 |
| 7907148 | 10.1021/jm00030a011 | Dopamine receptors; D1 & D2 | 1 |
| 7907148 | 10.1021/jm00030a011 | Unchecked | 1 |
| 7907148 | 10.1021/jm00030a011 | Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor | 1 |
| 8101877 | 10.1021/jm00067a009 | D(2) dopamine receptor | 1 |
| 7907148 | 10.1021/jm00030a011 | Serotonin 2 (5-HT2) receptor | 1 |
| 7907148 | 10.1021/jm00030a011 | D(1A) dopamine receptor | 1 |
| 7907148 | 10.1021/jm00030a011 | D(2) dopamine receptor | 1 |
| 8101877 | 10.1021/jm00067a009 | Dopamine receptors; D1 & D2 | 1 |
| 8101877 | 10.1021/jm00067a009 | Unchecked | 1 |
| 8101877 | 10.1021/jm00067a009 | Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor | 1 |
| 8101877 | 10.1021/jm00067a009 | Muscarinic acetylcholine receptor | 1 |
| 8101877 | 10.1021/jm00067a009 | Serotonin 2 (5-HT2) receptor | 1 |
Data from ChEMBL 36 via Core Engine