Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 5/20 | 0.57 |
| ▸ | CYSLTR1 | Q9Y271 | 5/20 | 0.57 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | GMNN | O75496 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8032669 | 1.00 | GPBAR1 (0.57) | GPBAR1CYSLTR1CYSLTR2MAPK1TP53 | |
| SCHEMBL8029280 | 0.90 | GPBAR1 (0.55) | GPBAR1CYSLTR1CYSLTR2MAPK1TP53 | |
| SCHEMBL8029284 | 0.90 | GPBAR1 (0.55) | GPBAR1CYSLTR1CYSLTR2MAPK1TP53 | |
| Hydrochloric Acid SCHEMBL9345393 | 0.90 | GPBAR1 (0.54) | GPBAR1CYSLTR1CYSLTR2MAPK1TP53 | |
| SCHEMBL8029082 | 0.87 | GPBAR1 (0.53) | GPBAR1CYSLTR1CYSLTR2MAPK1TP53 | |
| SCHEMBL8029077 | 0.87 | GPBAR1 (0.53) | GPBAR1CYSLTR1CYSLTR2MAPK1TP53 | |
| SCHEMBL8462237 | 0.84 | LTB4R (0.60) | GPBAR1CYSLTR1CYSLTR2ALOX5LTB4R | |
| SCHEMBL8462235 | 0.84 | LTB4R (0.60) | GPBAR1CYSLTR1CYSLTR2ALOX5LTB4R | |
| SCHEMBL8030782 | 0.77 | LTB4R (0.46) | GPBAR1CYSLTR1CYSLTR2LTB4RPDE10A | |
| SCHEMBL8030785 | 0.77 | LTB4R (0.46) | GPBAR1CYSLTR1CYSLTR2LTB4RPDE10A |
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 |
|---|---|---|---|---|---|---|---|
| US-6166031-A | Substituted tetralins, chromans and related compounds in the treatment of asthma | PFIZER INC, (US) | 2000-12-26 | — | — | US | disclosed |
| WO-1989003681-A1 | SUBSTITUTED TETRALINS, CHROMANS AND RELATED COMPOUNDS IN THE TREATMENT OF ASTHMA | PFIZER INC. (US) | 1989-05-05 | — | — | WO | disclosed |