Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | RXRA | P19793 | 14/20 | 0.41 |
| ▸ | RARG | P13631 | 11/20 | 0.41 |
| ▸ | RARA | P10276 | 9/20 | 0.41 |
| ▸ | RARB | P10826 | 9/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7872262 | 1.00 | CYP3A4 (0.43) | CYP3A4RXRARARGRARARARB | |
| SCHEMBL7878351 | 0.84 | RXRA (0.53) | CYP3A4RXRARARGRARARARB | |
| SCHEMBL7878348 | 0.84 | RXRA (0.53) | CYP3A4RXRARARGRARARARB | |
| SCHEMBL7872246 | 0.82 | CYP3A4 (0.43) | CYP3A4RXRARARGRARARARB | |
| SCHEMBL7872249 | 0.82 | CYP3A4 (0.43) | CYP3A4RXRARARGRARARARB | |
| SCHEMBL7898074 | 0.74 | RXRA (0.52) | RXRARARGRARARARBCYP26A1 | |
| SCHEMBL7566119 | 0.73 | RXRA (0.54) | CYP3A4RXRARARGRARARARB | |
| SCHEMBL7565076 | 0.73 | RXRA (0.54) | CYP3A4RXRARARGRARARARB | |
| SCHEMBL7872163 | 0.73 | RXRA (0.54) | CYP3A4RXRARARGRARARARB | |
| SCHEMBL7872231 | 0.73 | RARB (0.67) | CYP3A4RXRARARGRARARARB |
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 |
|---|---|---|---|---|---|---|---|
| US-6326510-B1 | SKIN DISORDERS; ANTICANCER AGENTS | CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) | 2001-12-04 | — | — | US | disclosed |