Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | FDPS | P14324 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL27671625 | 0.96 | CYP2C19 (0.48) | CYP2C19CYP1A2CYP2C9SLC6A2TAAR1 | |
| SCHEMBL11106147 | 0.88 | TAAR1 (0.44) | CYP2C19CYP1A2CYP2C9SLC6A2TAAR1 | |
| SCHEMBL1825667 | 0.86 | CYP1A2 (0.52) | CYP2C19CYP1A2CYP2C9SLC6A2TAAR1 | |
| SCHEMBL2579939 | 0.86 | CYP1A2 (0.52) | CYP2C19CYP1A2CYP2C9SLC6A2TAAR1 | |
| SCHEMBL14779954 | 0.86 | GAA (0.44) | CYP2C19CYP1A2CYP2C9SLC6A2TAAR1 | |
| Ammonia Solution, Strong SCHEMBL8191774 | 0.84 | CYP2C9 (0.50) | CYP2C19CYP1A2CYP2C9SLC6A2TAAR1 | |
| SCHEMBL875438 | 0.83 | CYP2C19 (0.48) | CYP2C19CYP1A2CYP2C9SLC6A2TAAR1 | |
| SCHEMBL28607388 | 0.81 | CYP1A2 (0.61) | CYP2C19CYP1A2CYP2C9SLC6A2TAAR1 | |
| SCHEMBL15255042 | 0.81 | SLC6A2 (0.48) | CYP2C19CYP1A2CYP2C9SLC6A2TAAR1 | |
| SCHEMBL11483933 | 0.81 | TDP1 (0.43) | CYP2C19SLC6A2TAAR1FDPSTP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017120194-A1 | PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS | INCYTE CORPORATION (US) | 2017-07-13 | — | — | WO | disclosed |
| WO-2010110400-A1 | HETEROCYCLIC COMPOUND | 武田薬品工業株式会社 (JP) | 2010-09-30 | — | — | WO | disclosed |
| WO-1993016996-A1 | INDOLE DERIVATIVES AS TESTOSTERONE-5-ALPHA-REDUCTASE INHIBITORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1993-09-02 | — | — | WO | disclosed |