Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL29176812 | 0.98 | ALDH1A1 (0.44) | ALDH1A1LMNAHDAC1HDAC2FFAR3 | |
| SCHEMBL8997372 | 0.84 | LMNA (0.61) | ALDH1A1LMNAMAPK1MAPTCYP1A2 | |
| SCHEMBL9215060 | 0.84 | LMNA (0.61) | ALDH1A1LMNAMAPK1MAPTCYP1A2 | |
| SCHEMBL180769 | 0.83 | ALDH1A1 (0.46) | ALDH1A1LMNAHDAC1HDAC2FFAR3 | |
| SCHEMBL28023347 | 0.82 | SMN1; SMN2 (0.39) | ALDH1A1HDAC1HDAC2FFAR3ACE | |
| SCHEMBL9219486 | 0.82 | CA1 (0.39) | LMNAACESMN1; SMN2CYP1A2BLM | |
| SCHEMBL4952099 | 0.82 | ALDH1A1 (0.41) | ALDH1A1LMNAHDAC1HDAC2FFAR3 | |
| SCHEMBL28380784 | 0.82 | LMNA (0.44) | ALDH1A1LMNAMAPK1MAPTTDP1 | |
| SCHEMBL1404146 | 0.80 | KLK7 (0.38) | HDAC1HDAC2ACEMAPK1SMN1; SMN2 | |
| SCHEMBL27521149 | 0.79 | ALDH1A1 (0.43) | ALDH1A1LMNAMAPK1MAPTTDP1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113474324-A | Isobutyrate compounds having n-butyryloxy group at alpha position, fragrance compositions and use as fragrance | 三菱瓦斯化学株式会社 | 2021-10-01 | — | — | CN | disclosed |
| US-5510428-A | Compositions, epoxized compositions, a heat curable resin composition, an epoxy resin composition, radically polymerized compositions, a curable resin composition and a polymer having epoxy groups | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 1996-04-23 | — | — | US | disclosed |
| WO-1995009145-A1 | NUTRITIVE GLYCEROL ESTERS OF β-ACYLOXY BUTYRATES | EASTMAN CHEMICAL COMPANY (US) | 1995-04-06 | — | — | WO | disclosed |
| EP-0141968-B1 | PYRROLYLAMINOPIPERIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1988-05-18 | — | — | EP | disclosed |
| EP-0266217-A2 | Process for producing optically active compounds | CHISSO CORPORATION (JP) | 1988-05-04 | — | — | EP | disclosed |
| US-4546105-A | ANALGESICS | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1985-10-08 | — | — | US | disclosed |
| EP-0141968-A1 | Pyrrolylaminopiperidines, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1985-05-22 | — | — | EP | disclosed |
| US-4452803-A | ANALGESICS | HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) | 1984-06-05 | — | — | US | disclosed |