Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 11/20 | 0.54 |
| ▸ | RXRB | P28702 | 9/20 | 0.54 |
| ▸ | RARB | P10826 | 11/20 | 0.46 |
| ▸ | RARG | P13631 | 11/20 | 0.46 |
| ▸ | RARA | P10276 | 8/20 | 0.46 |
| ▸ | CYP26A1 | O43174 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.43 |
| ▸ | RXRG | P48443 | 6/20 | 0.40 |
| ▸ | CRABP2 | P29373 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11227826 | 0.89 | RXRA (0.43) | RXRARXRBRARBRARGRARA | |
| SCHEMBL3175854 | 0.84 | RXRA (0.57) | RXRARXRBRARBRARGRARA | |
| SCHEMBL3541162 | 0.81 | RXRA (0.58) | RXRARXRBRARBRARGRARA | |
| Bromide SCHEMBL10816015 | 0.79 | RXRA (0.53) | RXRARXRBRARBRARGRARA | |
| SCHEMBL3819800 | 0.79 | RXRA (0.49) | RXRARXRBRARBRARGRARA | |
| SCHEMBL6144896 | 0.77 | RXRA (0.54) | RXRARXRBRARBRARGRARA | |
| SCHEMBL6144891 | 0.77 | RXRA (0.54) | RXRARXRBRARBRARGRARA | |
| SCHEMBL7759792 | 0.77 | RXRA (0.70) | RXRARXRBRARBRARGRARA | |
| SCHEMBL10555380 | 0.76 | RARA (0.44) | RXRARXRBRARBRARGRARA | |
| SCHEMBL9626091 | 0.76 | RARB (0.51) | RXRARXRBRARBRARGRARA |
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 |
|---|---|---|---|---|---|---|---|
| US-4326055-A | ANTITUMOR AGENTS, SKIN DISORDERS, RHEUMATIC DISEASES | HOFFMANN-LA ROCHE INC. (US) | 1982-04-20 | — | — | US | disclosed |
| US-4316983-A | Neoplasmic compounds: sugar esters and glycosides | HOFFMANN-LA ROCHE INC. (US) | 1982-02-23 | — | — | US | disclosed |
| US-4193931-A | 7-(INDANYL OR NAPHTHYL)-3-METHYL-OCTA-2,4,6-TRIENE DERIVATIVES, ANTITUMOR | HOFFMANN-LA ROCHE INC. (US) | 1980-03-18 | — | — | US | disclosed |