Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 2/20 | 0.49 |
| ▸ | HTR2C | P28335 | 2/20 | 0.49 |
| ▸ | HTR1B | P28222 | 1/20 | 0.49 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
| ▸ | RARB | P10826 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2676039 | 1.00 | NR5A1 (0.50) | NR5A1HTR2AHTR2CHTR1BHTR2B | |
| SCHEMBL4754947 | 0.96 | NR5A1 (0.46) | NR5A1HTR2AHTR2CHTR1BHTR2B | |
| SCHEMBL17186624 | 0.92 | HTR2A (0.44) | NR5A1HTR2AHTR2CHTR1BHTR2B | |
| SCHEMBL17694325 | 0.88 | PTPN11 (0.45) | NR5A1RARBCYP3A4CYP2D6PTPN11 | |
| SCHEMBL21537508 | 0.83 | CYP11B1 (0.43) | CYP3A4CYP2D6PTPN11CYP1A2CYP2C9 | |
| SCHEMBL22454339 | 0.83 | ITGB3 (0.40) | CYP3A4CYP2D6KDM4ELMNARAB9A | |
| SCHEMBL18417228 | 0.82 | CYP3A4 (0.43) | NR5A1HTR2AHTR2CHTR1BHTR2B | |
| SCHEMBL24270372 | 0.82 | CYP19A1 (0.50) | NR5A1HTR2AHTR2CHTR1BHTR2B | |
| SCHEMBL2671959 | 0.81 | CYP2D6 (0.50) | CYP3A4CYP2D6HPGDKDM4EALDH1A1 | |
| SCHEMBL18418553 | 0.80 | PDK2 (0.43) | HTR2AHTR2CHTR1BHTR2BRARB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020189519-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT AND COMPOUND | 国立大学法人九州大学 | 2020-09-24 | — | — | WO | disclosed |