Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
| ▸ | TACR2 | P21452 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL25922202 | 0.92 | TYR (0.47) | TYRTSHRTP53CYP3A4MEN1 | |
| SCHEMBL5684607 | 0.86 | TYR (0.53) | TYRTSHRTP53CYP3A4MEN1 | |
| SCHEMBL3657714 | 0.86 | ALOX5 (0.44) | TYRTSHRTP53CYP3A4MEN1 | |
| SCHEMBL11572449 | 0.84 | ALOX5 (0.45) | TYRTSHRTP53CYP3A4MEN1 | |
| SCHEMBL11570168 | 0.84 | ALOX5 (0.45) | TYRTSHRTP53CYP3A4MEN1 | |
| SCHEMBL11571261 | 0.84 | ALOX5 (0.45) | TYRTSHRTP53CYP3A4MEN1 | |
| SCHEMBL11571145 | 0.84 | TSHR (0.42) | TYRTSHRTP53CYP3A4MEN1 | |
| SCHEMBL11587871 | 0.83 | TYR (0.54) | TYRTSHRTP53CYP3A4MEN1 | |
| SCHEMBL9850753 | 0.83 | TYR (0.50) | TYRTSHRTP53CYP3A4MEN1 | |
| SCHEMBL14220741 | 0.83 | IDO1 (0.34) | TYRTSHRTP53CYP3A4MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107108861-B | hole transport material | 株式会社LG化学 | 2019-11-12 | — | — | CN | disclosed |
| CN-107108861-A | Hole mobile material | E.I.内穆尔杜邦公司 | 2017-08-29 | — | — | CN | disclosed |