Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.42 |
| ▸ | RPS6KA1 | Q15418 | 1/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.42 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.42 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ACP3 | P15309 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3212595 | 0.78 | CTSK (0.63) | CTSSCTSKATMGPR88 | |
| SCHEMBL5743400 | 0.78 | CTSK (0.63) | CTSSCTSKATMGPR88 | |
| SCHEMBL3212586 | 0.78 | CTSK (0.63) | CTSSCTSKATMGPR88 | |
| SCHEMBL18120821 | 0.77 | SLC6A4 (0.49) | EPHX1ATMCYP3A4CYP2C9PDGFRA | |
| SCHEMBL18120825 | 0.77 | SLC6A4 (0.49) | EPHX1ATMCYP3A4CYP2C9PDGFRA | |
| Tert-Butyl Formate SCHEMBL28841632 | 0.77 | CNR1 (0.41) | CTSSCTSKATMCYP3A4CYP2C9 | |
| SCHEMBL5170849 | 0.75 | TACR3 (0.46) | EPHX1CYP3A4CYP2C9MAPK1GPR88 | |
| SCHEMBL19652060 | 0.75 | TACR3 (0.46) | EPHX1CYP3A4CYP2C9MAPK1GPR88 | |
| SCHEMBL10090088 | 0.74 | LMNA (0.44) | EPHX1CYP3A4CYP2C9PDGFRAMAPK1 | |
| SCHEMBL22502277 | 0.74 | LMNA (0.49) | EPHX1CYP3A4CYP2C9PDGFRAMAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016053855-A1 | SPHINGOSINE-1-PHOSPATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2016-04-07 | — | — | WO | disclosed |