Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 5/20 | 1.00 |
| ▸ | DRD2 | P14416 | 6/20 | 0.54 |
| ▸ | DRD4 | P21917 | 2/20 | 0.54 |
| ▸ | DRD3 | P35462 | 2/20 | 0.49 |
| ▸ | DRD1 | P21728 | 3/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | THPO | P40225 | 1/20 | 0.48 |
| ▸ | MTOR | P42345 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL25384852 | 1.00 | MAOA (1.00) | MAOADRD2DRD4DRD3DRD1 | |
| SCHEMBL8278403 | 1.00 | MAOA (1.00) | MAOADRD2DRD4DRD3DRD1 | |
| SCHEMBL14755354 | 0.88 | MAOA (0.78) | MAOADRD2DRD4DRD3DRD1 | |
| SCHEMBL8034415 | 0.84 | MAOA (0.97) | MAOADRD2DRD3DRD1HSD17B10 | |
| SCHEMBL14739491 | 0.84 | MAOA (0.86) | MAOADRD2DRD3DRD1MAPK1 | |
| SCHEMBL15161703 | 0.79 | MAOA (0.66) | MAOADRD2DRD4DRD1HSD17B10 | |
| SCHEMBL8032032 | 0.78 | MAOA (0.64) | MAOADRD2DRD4DRD3DRD1 | |
| SCHEMBL8032028 | 0.78 | MAOA (0.64) | MAOADRD2DRD1HSD17B10KDM4E | |
| SCHEMBL8034457 | 0.78 | MAOA (0.64) | MAOADRD2DRD4HSD17B10MAPK1 | |
| SCHEMBL21444623 | 0.77 | MAOA (0.63) | MAOADRD2DRD4DRD3DRD1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2694158-B1 | SYSTEM AND DEVICE FOR ABLATION OF A VESSEL'S WALL FROM THE INSIDE | MEDICAL DEVELOPMENT TECH S A (LU) | 2018-12-19 | — | — | EP | claimed |
| US-20220238226-A1 | METHOD FOR PREDICTING MEDICINAL EFFECTS OF COMPOUNDS USING DEEP LEARNING | BIO-SYNERGY RESEARCH CENTER (KR) | 2022-07-28 | — | — | US | disclosed |
| EP-2420237-A1 | Fluorinated derivatives of endogenous isoquinolines for use in the treatment of diseases mediated through endogenous isoquinoline pathways | Takio Ville (FI) | 2012-02-22 | — | — | EP | disclosed |