Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | APP | P05067 | 2/20 | 0.33 |
| ▸ | BCHE | P06276 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | GFER | P55789 | 1/20 | 0.30 |
| ▸ | PLEC | Q15149 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25884154 | 0.79 | IDO1 (0.39) | IDO1TSHRRECQLKDM4EMAPT | |
| SCHEMBL25876836 | 0.74 | IDO1 (0.44) | IDO1CYP3A4TSHRRECQLAPP | |
| SCHEMBL14023489 | 0.69 | IDO1 (0.43) | IDO1CYP3A4TSHRRECQLAPP | |
| SCHEMBL526384 | 0.67 | IDO1 (0.52) | IDO1CYP3A4TSHRRECQLAR | |
| SCHEMBL22043300 | 0.67 | CYP1A2 (0.42) | TSHRACHEKDM4EHSD17B10ALDH1A1 | |
| Hydrochloric Acid SCHEMBL5804938 | 0.65 | IDO1 (0.50) | IDO1CYP3A4TSHRRECQLAR | |
| Iodide SCHEMBL27185482 | 0.65 | IDO1 (0.50) | IDO1CYP3A4TSHRRECQLAR | |
| SCHEMBL60765 | 0.64 | CA12 (0.60) | IDO1CYP3A4TSHRRECQLKDM4E | |
| SCHEMBL29828333 | 0.64 | CA12 (0.60) | IDO1CYP3A4TSHRRECQLKDM4E | |
| SCHEMBL27648630 | 0.64 | CA12 (0.60) | IDO1CYP3A4TSHRRECQLKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-4215526-A1 | CARBONYL HETEROCYCLIC COMPOUND AND APPLICATION THEREOF | Shanghai Pharmaceuticals Holding Co., Ltd. (CN) | 2023-07-26 | — | — | EP | disclosed |