Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 10/20 | 0.74 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.74 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.59 |
| ▸ | MEN1 | O00255 | 3/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | TSHR | P16473 | 3/20 | 0.57 |
| ▸ | TP53 | P04637 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.54 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.54 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL13232695 | 0.89 | USP2 (0.67) | USP2CYP2D6CYP2C9CYP3A4ALDH1A1 | |
| SCHEMBL23025784 | 0.83 | USP2 (0.70) | USP2CYP2D6CYP2C9CYP3A4ALDH1A1 | |
| SCHEMBL2629498 | 0.82 | USP2 (0.59) | USP2CYP2D6CYP2C9CYP3A4ALDH1A1 | |
| Hydrochloric Acid SCHEMBL30328579 | 0.81 | USP2 (0.68) | USP2CYP2D6CYP2C9CYP3A4ALDH1A1 | |
| SCHEMBL1107775 | 0.79 | USP2 (0.55) | USP2CYP2D6CYP2C9CYP3A4ALDH1A1 | |
| SCHEMBL13673998 | 0.79 | USP2 (0.55) | USP2CYP2D6CYP2C9CYP3A4ALDH1A1 | |
| SCHEMBL576454 | 0.79 | LMNA (0.67) | USP2CYP2D6CYP3A4ALDH1A1MAPK1 | |
| SCHEMBL385012 | 0.79 | — | — | |
| SCHEMBL164538 | 0.79 | LMNA (0.67) | USP2CYP2D6CYP3A4ALDH1A1MAPK1 | |
| SCHEMBL576814 | 0.79 | LMNA (0.67) | USP2CYP2D6CYP3A4ALDH1A1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118598798-A | Preparation method for directly synthesizing arylamine compound based on aromatic hydrocarbon and fatty amine | 沈阳药科大学 | 2024-09-06 | — | — | CN | disclosed |
| WO-2023217232-A1 | KINESIN KIF18A INHIBITOR AND USE THEREOF | 上海湃隆生物科技有限公司 | 2023-11-16 | — | — | WO | disclosed |
| WO-2012047703-A2 | CYCLOPROPYL-SPIRO-PIPERIDINES USEFUL AS SODIUM CHANNEL BLOCKERS | SCHERING CORPORATION (US) | 2012-04-12 | — | — | WO | disclosed |