Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | S100B | P04271 | 1/20 | 0.32 |
| ▸ | TERT | O14746 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CD44 | P16070 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16550078 | 1.00 | CYP3A4 (0.40) | CYP3A4TSHRMAPK1ALDH1A1TDP1 | |
| SCHEMBL1144875 | 0.82 | NQO2 (0.35) | CYP3A4TSHRMAPK1ALDH1A1TDP1 | |
| SCHEMBL13550087 | 0.75 | CYP3A4 (0.38) | CYP3A4TSHRALDH1A1TDP1ALOX15 | |
| SCHEMBL159075 | 0.75 | ALDH1A1 (0.43) | CYP3A4TSHRMAPK1ALDH1A1TDP1 | |
| SCHEMBL29865173 | 0.75 | DGAT1 (0.34) | ALDH1A1IDO1TDO2 | |
| SCHEMBL25162025 | 0.75 | ALDH1A1 (0.52) | CYP3A4TSHRMAPK1ALDH1A1TDP1 | |
| SCHEMBL15709089 | 0.75 | CYP3A4 (0.38) | CYP3A4TSHRTDP1IDO1TDO2 | |
| SCHEMBL13550061 | 0.75 | RAPGEF4 (0.34) | NPC1RAB9ANQO2 | |
| SCHEMBL6670544 | 0.75 | CYP3A4 (0.43) | CYP3A4TSHRMAPK1ALDH1A1TDP1 | |
| SCHEMBL29603436 | 0.75 | RAPGEF4 (0.34) | NPC1RAB9ANQO2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2025059040-A1 | MUTANT KRAS MODULATORS AND USES THEREOF | NEWAVE PHARMACEUTICAL INC. (US) | 2025-03-20 | — | — | WO | disclosed |
| WO-2024104453-A1 | FUSED TRICYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL USE THEREOF | 江苏恒瑞医药股份有限公司 | 2024-05-23 | — | — | WO | disclosed |