Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TACR2 | P21452 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | ACLY | P53396 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25300279 | 1.00 | IDO1 (0.39) | IDO1CYP1A2EGFRALDH1A1MAPT | |
| SCHEMBL14536291 | 0.86 | ERN1 (0.38) | CYP1A2EGFRALDH1A1MAPTL3MBTL1 | |
| SCHEMBL3605246 | 0.86 | ERN1 (0.38) | CYP1A2EGFRALDH1A1MAPTL3MBTL1 | |
| SCHEMBL25299365 | 0.81 | IDO1 (0.39) | IDO1CYP1A2ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL791863 | 0.80 | IDO1 (0.58) | IDO1ALDH1A1MAPTL3MBTL1CYP3A4 | |
| SCHEMBL15795345 | 0.79 | HSD17B10 (0.38) | CYP1A2ALDH1A1MAPTL3MBTL1CYP3A4 | |
| SCHEMBL24851930 | 0.78 | MAOA (0.40) | IDO1ALDH1A1ERN1MEN1KMT2A | |
| SCHEMBL18003864 | 0.78 | ALDH1A1 (0.41) | IDO1CYP1A2ALDH1A1MAPTCYP2C19 | |
| SCHEMBL25370066 | 0.75 | ERN1 (0.39) | ALDH1A1MAPTERN1MEN1KMT2A | |
| SCHEMBL30511599 | 0.75 | ERN1 (0.39) | ALDH1A1MAPTERN1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-118541370-A | Azaindole derivatives and their use as ERK kinase inhibitors | AGV探索公司 | 2024-08-23 | — | — | CN | disclosed |