Compound Detail
CHEMBL378501
CYANOPINDOLOL Enter ChEMBL ID:
Free Research Context
This compound will appear in recent viewed items on the research home for this browser.
Research home
View demo workspace
Basic Information
| ChEMBL ID | CHEMBL378501 |
| Name | CYANOPINDOLOL |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QXIUMMLTJVHILT-UHFFFAOYSA-N |
2
Targets
7
Activities
2
Assay Types
0
PK Parameters
6
Publications
0
Known Names
Molecular Properties
287.4
MW (Da)
2.17
ALogP
4
HBA
3
HBD
81.1
PSA (Ų)
0.79
QED
0
Ro5 Violations
5
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 5 meas. best 10.4
Kd 2 meas. best 9.15
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Beta-1 adrenergic receptor CHEMBL3252 | Ki | 10.4 | 9.32 | 0.0 | 5 |
| Beta-2 adrenergic receptor CHEMBL210 | Kd | 9.15 | 9.15 | 0.7 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Beta-1 adrenergic receptor | Ki | = | 0.03981 | nM | 10.4 | Antagonist activity at rat beta-1 adrenergic receptor Y356F mutant expressed in ... | 16759089 |
| Beta-1 adrenergic receptor | Ki | = | 0.05012 | nM | 10.3 | Antagonist activity at rat wild type beta-1 adrenergic receptor expressed in CHO... | 16759089 |
| Beta-1 adrenergic receptor | Ki | = | 0.1259 | nM | 9.9 | Antagonist activity at rat beta-1 adrenergic receptor W134A mutant expressed in ... | 16759089 |
| Beta-1 adrenergic receptor | Ki | = | 0.3162 | nM | 9.5 | Antagonist activity at rat beta-1 adrenergic receptor S190A mutant expressed in ... | 16759089 |
| Beta-2 adrenergic receptor | Kd | = | 0.7 | nM | 9.15 | Displacement of [3H]DHA from inactive/G protein-uncoupled human beta2-AR express... | 27239696 |
| Beta-1 adrenergic receptor | Ki | = | 316.23 | nM | 6.5 | Antagonist activity at rat beta-1 adrenergic receptor Y356A mutant expressed in ... | 16759089 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16759089 | 10.1021/jm050624l | Beta-1 adrenergic receptor | 5 |
| 27239696 | 10.1021/acs.jmedchem.6b00358 | Beta-2 adrenergic receptor | 3 |
| - | 10.6019/CHEMBL4495565 | SARS-CoV-2 | 2 |
| - | 10.6019/CHEMBL4808148 | Histone deacetylase 6 | 2 |
| - | 10.21203/rs.3.rs-23951/v1 | SARS-CoV-2 | 1 |
| - | 10.6019/CHEMBL4495564 | Replicase polyprotein 1ab | 1 |
Data from ChEMBL 36 via Core Engine