Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | USP2 | O75604 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23995682 | 0.84 | SMN1; SMN2 (0.47) | SMN1; SMN2KDM4EALDH1A1MAPK1CYP2C19 | |
| SCHEMBL21078057 | 0.81 | CYP3A4 (0.47) | SMN1; SMN2KDM4EALDH1A1MAPK1CYP2C19 | |
| SCHEMBL21134521 | 0.81 | CYP3A4 (0.47) | SMN1; SMN2KDM4EALDH1A1MAPK1CYP2C19 | |
| SCHEMBL24279550 | 0.79 | CYP3A4 (0.46) | SMN1; SMN2KDM4EALDH1A1MAPK1CYP2C19 | |
| SCHEMBL12869368 | 0.78 | — | — | |
| SCHEMBL18390599 | 0.76 | CYP1A2 (0.54) | SMN1; SMN2KDM4EALDH1A1MAPK1CYP2C19 | |
| SCHEMBL19534271 | 0.76 | CYP1A2 (0.43) | SMN1; SMN2KDM4EALDH1A1MAPK1CYP2C19 | |
| SCHEMBL18478134 | 0.76 | SMN1; SMN2 (0.50) | SMN1; SMN2KDM4EALDH1A1MAPK1CYP2C19 | |
| SCHEMBL23345238 | 0.75 | SMN1; SMN2 (0.38) | SMN1; SMN2KDM4EALDH1A1MAPK1CYP2C19 | |
| SCHEMBL5986519 | 0.74 | OPRM1 (0.54) | SMN1; SMN2KDM4EALDH1A1MAPK1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023125737-A1 | HETEROCYCLIC COMPOUNDS AND USE THEREOF | SILEXON AI TECHNOLOGY CO., LTD. (CN) | 2023-07-06 | — | — | WO | disclosed |