Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TYMS | P04818 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | MIF | P14174 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Anthraquinone SCHEMBL14723446 | 0.80 | TDP1 (0.48) | MAOACES1TDP1ALDH1A1GLA | |
| Anthrone SCHEMBL28140292 | 0.79 | MAOA (0.58) | MAOBMAOACES1TDP1ALDH1A1 | |
| Phthalic Anhydride SCHEMBL6889860 | 0.78 | TDP1 (0.52) | TDP1ALDH1A1GLASMN1; SMN2TSHR | |
| Fluorene SCHEMBL154228 | 0.78 | TDP1 (0.47) | MAOATDP1ALDH1A1GLASMN1; SMN2 | |
| SCHEMBL1268680 | 0.77 | MAOA (0.74) | MAOBCYP2A6MAOACES1TDP1 | |
| SCHEMBL24746 | 0.77 | MAOA (0.74) | MAOBCYP2A6MAOACES1TDP1 | |
| SCHEMBL29353311 | 0.77 | MAOA (0.74) | MAOBCYP2A6MAOACES1TDP1 | |
| SCHEMBL5925483 | 0.76 | TDP1 (0.52) | TDP1ALDH1A1GLASMN1; SMN2TSHR | |
| Phthalimide SCHEMBL27772908 | 0.76 | GSK3B (0.52) | MAOBMAOATDP1ALDH1A1GLA | |
| SCHEMBL31454252 | 0.75 | MAOA (0.71) | MAOBCYP2A6MAOACES1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4435397-A | ADRENERGIC BLOCKING AGENTS, 4-(3-ARYLOXY-2-HYDROXYPROPYL) SUBSTITUTED | NIPPON SHINYAKU CO., LTD. (JP) | 1984-03-06 | — | — | US | disclosed |