Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.57 |
| ▸ | MAOB | P27338 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11345673 | 0.81 | FLT3 (0.46) | MAOBKDM4EGPR35ALDH1A1CYP1A2 | |
| SCHEMBL12248487 | 0.77 | ALOX5 (0.56) | ALOX5MAOBKDM4EGPR35ALDH1A1 | |
| SCHEMBL10459871 | 0.74 | ALOX5 (0.57) | ALOX5MAOBKDM4EGPR35ALDH1A1 | |
| SCHEMBL11190837 | 0.74 | ALOX5 (0.54) | ALOX5MAOBKDM4EGPR35ALDH1A1 | |
| SCHEMBL20559684 | 0.74 | ALOX5 (0.57) | ALOX5MAOBKDM4EGPR35ALDH1A1 | |
| SCHEMBL2395181 | 0.72 | ALOX5 (1.00) | ALOX5MAOBKDM4EGPR35ALDH1A1 | |
| SCHEMBL8498814 | 0.72 | ALOX5 (0.56) | ALOX5MAOBKDM4EGPR35ALDH1A1 | |
| SCHEMBL8498815 | 0.72 | ALOX5 (0.53) | ALOX5MAOBKDM4EGPR35ALDH1A1 | |
| Hydrochloric Acid SCHEMBL10458742 | 0.72 | ALOX5 (0.56) | ALOX5MAOBKDM4EGPR35ALDH1A1 | |
| SCHEMBL16595668 | 0.72 | KDM4E (0.53) | ALOX5MAOBKDM4EGPR35ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0020391-A1 | SUBSTITUTED ACETIC ACID ESTERS | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1981-01-07 | — | — | EP | disclosed |
| WO-1980000563-A1 | SUBSTITUTED ACETIC ACID ESTERS | SOREX LTD (GB) | 1980-04-03 | — | — | WO | disclosed |