Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.51 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL16139564 | 0.71 | CES1 (0.44) | CES1MAOANPC1POLBPKM | |
| SCHEMBL23975284 | 0.71 | PTGS2 (0.40) | PTGS2PTGS1ESR1ESR2 | |
| SCHEMBL21703736 | 0.70 | PTGS2 (0.35) | PTGS2PTGS1BCHECES1ESR1 | |
| SCHEMBL6209822 | 0.68 | MAOA (0.43) | BCHECES1SLC6A4SLC6A3MAOA | |
| SCHEMBL21294262 | 0.68 | THRB (0.46) | PTGS1ESR1ESR2NPC1PKM | |
| SCHEMBL31185872 | 0.67 | PRKCB (0.49) | SMN1; SMN2CYP2D6ALDH1A1HSD17B10LMNA | |
| SCHEMBL2222606 | 0.66 | XDH (0.51) | PTGS2PTGS1SLC6A4SLC6A3POLB | |
| SCHEMBL1480938 | 0.66 | KDM4E (0.52) | PTGS2PTGS1SLC6A4SLC6A3MAOA | |
| SCHEMBL27375940 | 0.66 | PNMT (0.47) | PTGS2PTGS1NPC1TP53POLB | |
| SCHEMBL18032688 | 0.64 | CES1 (0.67) | BCHECES1MAOAPOLBPKM |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5032590-A | Substituted hydroxylamines | BAYER AKTIENGESELLSCHAFT (DE) | 1991-07-16 | — | — | US | disclosed |
| US-5001255-A | Idene analogs of mevalonolactone and derivatives thereof | SANDOZ PHARM. CORP. (US) | 1991-03-19 | — | — | US | disclosed |
| EP-0216785-B1 | INDENE ANALOGS OF MEVALONOLACTONE AND DERIVATIVES THEREOF | SANDOZ AG (CH) | 1991-01-30 | — | — | EP | disclosed |
| US-4968681-A | Substituted hydroxylamines | BAYER AKTIENGESELLSCHAFT (DE) | 1990-11-06 | — | — | US | disclosed |
| EP-0317845-A2 | Substituted hydroxyl amines | BAYER AG (DE) | 1989-05-31 | — | — | EP | disclosed |
| EP-0216785-A1 | INDENE ANALOGS OF MEVALONOLACTONE AND DERIVATIVES THEREOF. | SANDOZ AG (CH) | 1987-04-08 | — | — | EP | disclosed |
| WO-1986003488-A1 | INDENE ANALOGS OF MEVALONOLACTONE AND DERIVATIVES THEREOF | SANDOZ AG (CH) | 1986-06-19 | — | — | WO | disclosed |