Compound Detail
CHEMBL1050
LATANOPROST ACID 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
O=C(O)CCC/C=C\C[C@@H]1[C@@H](CC[C@@H](O)CCc2ccccc2)[C@H](O)C[C@@H]1O
Basic Information
| ChEMBL ID | CHEMBL1050 |
| Name | LATANOPROST ACID |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HNPFPERDNWXAGS-NFVOFSAMSA-N |
4
Targets
5
Activities
2
Assay Types
0
PK Parameters
7
Publications
1
Known Names
Molecular Properties
390.5
MW (Da)
3.32
ALogP
4
HBA
4
HBD
98.0
PSA (Ų)
0.32
QED
0
Ro5 Violations
12
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 3 meas. best 9.15
Ki 2 meas. best 7.01
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Felis catus CHEMBL612670 | EC50 | 9.15 | 9.15 | 0.7 | 1 |
| Prostaglandin F2-alpha receptor CHEMBL5000 | EC50 | 8.2 | 7.85 | 6.3 | 2 |
| Prostaglandin F2-alpha receptor CHEMBL4820 | Ki | 7.01 | 7.01 | 98.0 | 1 |
| Solute carrier organic anion transporter family member 2A1 CHEMBL2073703 | Ki | 6.83 | 6.83 | 149.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Felis catus | EC50 | = | 0.71 | nM | 9.15 | Compound concentration which had a contractile effect on iris sphincter muscle o... | 8423596 |
| Prostaglandin F2-alpha receptor | EC50 | = | 6.31 | nM | 8.2 | Agonist activity at FP receptor in mouse 3T3 fibroblast cells assessed as intrac... | 23317571 |
| Prostaglandin F2-alpha receptor | EC50 | = | 31.7 | nM | 7.5 | Agonist activity at FP receptor in Swiss mouse 3T3 cells assessed as [3H]-IP acc... | 19101156 |
| Prostaglandin F2-alpha receptor | Ki | = | 98.0 | nM | 7.01 | Displacement of [3H]PGF2 alpha from FP receptor in bovine corpus luteum membrane | 19101156 |
| Solute carrier organic anion transporter family member 2A1 | Ki | = | 149.0 | nM | 6.83 | TP_TRANSPORTER: inhibition of PGE1 uptake (PGE1: 0.0004 uM) in PGT-expressing He... | 11878817 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 19101156 | 10.1016/j.bmc.2008.11.070 | Prostaglandin F2-alpha receptor | 3 |
| 19101156 | 10.1016/j.bmc.2008.11.070 | Oryctolagus cuniculus | 3 |
| 23317571 | 10.1016/j.bmcl.2012.12.058 | Prostaglandin F2-alpha receptor | 2 |
| 8423596 | 10.1021/jm00054a008 | Felis catus | 1 |
| 11878817 | 10.1006/exer.2001.1104 | Solute carrier organic anion transporter family member 2A1 | 1 |
| 23317571 | 10.1016/j.bmcl.2012.12.058 | ADMET | 1 |
| 23317571 | 10.1016/j.bmcl.2012.12.058 | Caco-2 | 1 |
Data from ChEMBL 36 via Core Engine