Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.38 |
| ▸ | CYP26A1 | O43174 | 4/20 | 0.37 |
| ▸ | CYP26B1 | Q9NR63 | 3/20 | 0.37 |
| ▸ | RXRA | P19793 | 5/20 | 0.37 |
| ▸ | RARB | P10826 | 2/20 | 0.37 |
| ▸ | RARG | P13631 | 2/20 | 0.37 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | RARA | P10276 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | BLVRB | P30043 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24442807 | 0.88 | RARB (0.43) | AKR1C3AKR1C2CYP26A1RXRARARB | |
| SCHEMBL23445678 | 0.87 | RARA (0.40) | AKR1C3AKR1C2CYP26A1CYP26B1RXRA | |
| SCHEMBL22934074 | 0.84 | CYP26A1 (0.40) | ABCG2AKR1C3AKR1C2CYP26A1CYP26B1 | |
| SCHEMBL23442800 | 0.84 | RARB (0.46) | CYP26A1CYP26B1RXRARARBRARG | |
| SCHEMBL29945232 | 0.84 | RARB (0.46) | CYP26A1CYP26B1RXRARARBRARG | |
| SCHEMBL23439027 | 0.80 | CYP26A1 (0.46) | AKR1C3AKR1C2CYP26A1CYP26B1RXRA | |
| SCHEMBL26410429 | 0.79 | AKR1C3 (0.39) | AKR1C3AKR1C2CYP26A1CYP26B1RXRA | |
| SCHEMBL23444328 | 0.79 | RARA (0.39) | AKR1C3AKR1C2CYP26A1CYP26B1RXRA | |
| SCHEMBL23442477 | 0.78 | NPSR1 (0.47) | ABCG2AKR1C3AKR1C2RXRARARB | |
| SCHEMBL23118189 | 0.78 | AKR1C3 (0.46) | ABCG2AKR1C3AKR1C2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-113727985-A | Compound and organic light emitting device including the same | 株式会社LG化学 | 2021-11-30 | — | — | CN | disclosed |
| WO-2021049889-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2021-03-18 | — | — | WO | disclosed |
| US-9511058-B2 | Methods for using carboxamide, sulfonamide and amine compounds | RIGEL PHARMACEUTICALS INC. (US) | 2016-12-06 | — | — | US | disclosed |