Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.41 |
| ▸ | HTR3B | O95264 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.41 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 4/20 | 0.40 |
| ▸ | HTR2C | P28335 | 4/20 | 0.40 |
| ▸ | PDE1B | Q01064 | 2/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.40 |
| ▸ | PDE8B | O95263 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PDE1A | P54750 | 1/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.40 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.40 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20855753 | 1.00 | TP53 (0.43) | TP53ALDH1A1HTR3EHTR3BHTR3A | |
| SCHEMBL30036752 | 0.80 | CYP2C19 (0.52) | ALDH1A1MEN1KMT2ACYP2C19KDM4E | |
| SCHEMBL8423985 | 0.80 | CYP2C19 (0.52) | ALDH1A1MEN1KMT2ACYP2C19KDM4E | |
| SCHEMBL13651802 | 0.79 | TP53 (0.39) | TP53ALDH1A1HTR3EHTR3BHTR3A | |
| SCHEMBL18820312 | 0.79 | SLC6A2 (0.58) | HTR2BHTR2CHTR2ASLC6A2SLC6A4 | |
| SCHEMBL18908535 | 0.79 | MEN1 (0.48) | ALDH1A1MEN1KMT2AKDM4EPOLB | |
| SCHEMBL83692 | 0.79 | MEN1 (0.48) | ALDH1A1MEN1KMT2AKDM4EPOLB | |
| SCHEMBL13686388 | 0.77 | ACHE (0.44) | ALDH1A1MEN1KMT2AKDM4EPOLB | |
| SCHEMBL12309442 | 0.75 | KDM1A (0.47) | ALDH1A1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL7049820 | 0.75 | TP53 (0.42) | TP53ALDH1A1HTR2BHTR2CHTR2A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019063748-A1 | ROR-GAMMA INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2019-04-04 | — | — | WO | disclosed |
| WO-2019063748-A1 | ROR-GAMMA INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2019-04-04 | — | — | WO | disclosed |