Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC3 | O15438 | 1/20 | 0.59 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.59 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.59 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.59 |
| ▸ | TTR | P02766 | 1/20 | 0.59 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.59 |
| ▸ | PGR | P06401 | 1/20 | 0.59 |
| ▸ | HTR1A | P08908 | 1/20 | 0.59 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.59 |
| ▸ | RARB | P10826 | 1/20 | 0.59 |
| ▸ | COMT | P21964 | 1/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.59 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.59 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.59 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.59 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.59 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL24419776 | 0.91 | ALDH1A1 (0.61) | ABCC3ABCC4NR1I2ABCB11TTR | |
| SCHEMBL15511901 | 0.85 | TTR (0.54) | TTRALDH1A1LMNAHTTCA2 | |
| SCHEMBL24040822 | 0.83 | TTR (0.52) | TTRALDH1A1LMNAHTTCA2 | |
| SCHEMBL18805097 | 0.82 | ABCC3 (0.62) | ABCC3ABCC4NR1I2ABCB11TTR | |
| SCHEMBL24419781 | 0.81 | TTR (0.60) | ABCC3ABCC4NR1I2ABCB11TTR | |
| SCHEMBL30023323 | 0.79 | ALDH1A1 (0.50) | ABCC3ABCC4NR1I2ABCB11TTR | |
| SCHEMBL24419785 | 0.79 | TTR (0.59) | ABCC3ABCC4NR1I2ABCB11TTR | |
| SCHEMBL24419782 | 0.79 | CNR2 (0.64) | ABCC3ABCC4NR1I2ABCB11TTR | |
| SCHEMBL4863594 | 0.78 | ABCC3 (0.57) | ABCC3ABCC4NR1I2ABCB11TTR | |
| SCHEMBL12362778 | 0.77 | ALDH1A1 (0.84) | ABCC3ABCC4NR1I2ABCB11TTR |
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-2022098847-A1 | TOLCAPONE ANALOGS AND METHODS OF USE | CORINO THERAPEUTICS, INC. (US) | 2022-05-12 | — | — | WO | disclosed |