Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARA | P10276 | 12/20 | 0.46 |
| ▸ | RARB | P10826 | 11/20 | 0.46 |
| ▸ | RARG | P13631 | 10/20 | 0.44 |
| ▸ | RXRA | P19793 | 10/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | GMNN | O75496 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | THPO | P40225 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8796712 | 0.90 | RXRA (0.44) | RARARARBRARGRXRACYP3A4 | |
| SCHEMBL8795874 | 0.86 | RARA (0.44) | RARARARBRARGRXRACYP3A4 | |
| SCHEMBL8796307 | 0.82 | RARB (0.46) | RARARARBRARGRXRACYP3A4 | |
| SCHEMBL8796313 | 0.82 | RARB (0.46) | RARARARBRARGRXRACYP3A4 | |
| SCHEMBL3819796 | 0.80 | RARB (0.60) | RARARARBRARGRXRACYP3A4 | |
| SCHEMBL8796453 | 0.80 | RARA (0.41) | RARARARBRARGRXRACYP3A4 | |
| Arotinoid SCHEMBL2890175 | 0.76 | RARG (0.70) | RARARARBRARGRXRACYP3A4 | |
| Arotinoid SCHEMBL29430179 | 0.76 | RARG (0.70) | RARARARBRARGRXRACYP3A4 | |
| Arotinoid SCHEMBL2890176 | 0.76 | RARG (0.70) | RARARARBRARGRXRACYP3A4 | |
| SCHEMBL8795929 | 0.76 | PLA2G4A (0.51) | RARARARBRARGRXRANPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0629604-B1 | Alicyclic phospholipase A2 inhibitors | BRISTOL MYERS SQUIBB CO (US) | 1997-04-16 | — | — | EP | disclosed |
| US-5436369-A | Alicyclic phospholipase A2 inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-07-25 | — | — | US | disclosed |
| EP-0629604-A2 | Alicyclic phospholipase A2 inhibitors | Bristol-Myers Company (US) | 1994-12-21 | — | — | EP | disclosed |