Compound Detail
CHEMBL14812
GT-2016 Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL14812 |
| Name | GT-2016 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YTCGNPGLMAECND-UHFFFAOYSA-N |
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
317.5
MW (Da)
4.26
ALogP
2
HBA
1
HBD
49.0
PSA (Ų)
0.80
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 2 meas. best 7.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Histamine H3 receptor CHEMBL4124 | Ki | 7.4 | 7.4 | 40.0 | 2 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Histamine H3 receptor | Ki | = | 40.0 | nM | 7.4 | Inhibition of [3H]- N-alpha-methylhistamine from histamine H3 receptor | 9871722 |
| Histamine H3 receptor | Ki | = | 40.0 | nM | 7.4 | Histamine H3 receptor affinity of compound was determined in rat cortical membra... | - |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 9871722 | 10.1016/s0960-894x(98)00181-4 | Histamine H3 receptor | 1 |
| - | 10.1016/S0960-894X(97)10137-8 | Histamine H3 receptor | 1 |
Data from ChEMBL 36 via Core Engine