Compound Detail
CHEMBL6640
TRYPTAMINE Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL6640 |
| Name | TRYPTAMINE |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | APJYDQYYACXCRM-UHFFFAOYSA-N |
22
Targets
35
Activities
4
Assay Types
0
PK Parameters
20
Publications
0
Known Names
Molecular Properties
160.2
MW (Da)
1.67
ALogP
1
HBA
2
HBD
41.8
PSA (Ų)
0.69
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 18 meas. best 7.64
EC50 7 meas. best 8.13
IC50 7 meas. best 6.11
Kd 3 meas. best 6.27
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| 5-hydroxytryptamine receptor 2A CHEMBL224 | EC50 | 8.13 | 8.13 | 7.4 | 1 |
| 5-hydroxytryptamine receptor 1D CHEMBL1983 | Ki | 7.64 | 7.425 | 23.0 | 2 |
| Sodium-dependent serotonin transporter CHEMBL313 | EC50 | 7.49 | 7.49 | 32.6 | 1 |
| 5-hydroxytryptamine receptor 1B CHEMBL1898 | Ki | 7.44 | 7.44 | 36.0 | 1 |
| Serotonin 2 (5-HT2) receptor CHEMBL2093870 | Ki | 7.3 | 6.42 | 50.0 | 2 |
| 5-hydroxytryptamine receptor 2C CHEMBL225 | Ki | 7.3 | 7.3 | 50.0 | 1 |
| 5-hydroxytryptamine receptor 6 CHEMBL3371 | Ki | 7.16 | 6.955 | 70.0 | 2 |
| 5-hydroxytryptamine receptor 7 CHEMBL3155 | Ki | 6.8 | 6.8 | 158.5 | 1 |
| Sodium-dependent dopamine transporter CHEMBL338 | EC50 | 6.79 | 6.79 | 164.0 | 1 |
| 5-hydroxytryptamine receptor 1A CHEMBL273 | Ki | 6.77 | 6.77 | 169.8 | 2 |
| Trace amine-associated receptor 1 CHEMBL3833 | EC50 | 6.51 | 6.51 | 310.0 | 1 |
| 5-hydroxytryptamine receptor 2B CHEMBL323 | Kd | 6.27 | 6.27 | 537.0 | 1 |
| Norepinephrine transporter CHEMBL304 | EC50 | 6.14 | 6.14 | 716.0 | 1 |
| Myeloperoxidase CHEMBL2439 | IC50 | 6.11 | 6.11 | 770.0 | 1 |
| Cytochrome P450 2A6 CHEMBL5282 | Ki | 5.77 | 5.77 | 1700.0 | 1 |
| Trace amine-associated receptor 1 CHEMBL5857 | EC50 | 5.66 | 5.66 | 2210.0 | 1 |
| Cytochrome P450 2A6 CHEMBL5282 | Kd | 5.64 | 5.64 | 2300.0 | 1 |
| Cytochrome P450 2A13 CHEMBL3542436 | Kd | 5.28 | 5.28 | 5200.0 | 1 |
| Unchecked CHEMBL612545 | Ki | 5.27 | 5.27 | 5400.0 | 1 |
| NON-PROTEIN TARGET CHEMBL3879801 | IC50 | 5.22 | 4.9 | 6000.0 | 3 |
| 5-hydroxytryptamine receptor 1B CHEMBL3459 | Ki | 4.99 | 4.99 | 10200.0 | 1 |
| Cathepsin K CHEMBL268 | IC50 | 4.82 | 4.82 | 15000.0 | 1 |
| Cytochrome P450 2A13 CHEMBL3542436 | Ki | 4.8 | 4.8 | 16000.0 | 1 |
| Adrenergic receptor alpha-2 CHEMBL2093864 | Ki | 4.72 | 4.72 | 19000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine