Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARG | P13631 | 14/20 | 0.57 |
| ▸ | RXRA | P19793 | 13/20 | 0.57 |
| ▸ | RARB | P10826 | 12/20 | 0.57 |
| ▸ | RARA | P10276 | 12/20 | 0.57 |
| ▸ | CYP26A1 | O43174 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | GMNN | O75496 | 1/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | THPO | P40225 | 1/20 | 0.57 |
| ▸ | MTOR | P42345 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL7769560 | 1.00 | RARG (0.57) | RARGRXRARARBRARACYP26A1 | |
| SCHEMBL7771292 | 0.91 | RARG (0.57) | RARGRXRARARBRARACYP26A1 | |
| SCHEMBL7771294 | 0.91 | RARG (0.57) | RARGRXRARARBRARACYP26A1 | |
| SCHEMBL6730317 | 0.89 | CYP3A4 (0.49) | RARGRXRARARBRARACYP26A1 | |
| SCHEMBL6730316 | 0.89 | CYP3A4 (0.49) | RARGRXRARARBRARACYP26A1 | |
| SCHEMBL7771734 | 0.87 | RXRA (0.58) | RARGRXRARARBRARACYP26A1 | |
| SCHEMBL7771737 | 0.87 | RXRA (0.58) | RARGRXRARARBRARACYP26A1 | |
| SCHEMBL8100641 | 0.81 | RARG (0.50) | RARGRXRARARBRARACYP26A1 | |
| SCHEMBL6733979 | 0.80 | CYP3A4 (0.49) | RARGRXRARARBRARACYP26A1 | |
| SCHEMBL6733982 | 0.80 | CYP3A4 (0.49) | RARGRXRARARBRARACYP26A1 |
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-0823903-B1 | HETEROCYCLIC DIARYL COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME, AND USES THEREOF | CT INTERNAT DE RECH S (FR) | 2001-07-18 | — | — | EP | disclosed |
| EP-0823903-A1 | HETEROCYCLIC DIARYL COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME, AND USES THEREOF | CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA, ( CIRD GALDERMA) (FR) | 1998-02-18 | — | — | EP | disclosed |
| WO-1997029100-A1 | HETEROCYCLIC DIARYL COMPOUNDS, PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME, AND USES THEREOF | CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) | 1997-08-14 | — | — | WO | disclosed |