Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | PPARG | P37231 | 1/20 | 0.55 |
| ▸ | PPARA | Q07869 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | AKT1 | P31749 | 1/20 | 0.54 |
| ▸ | IRS1 | P35568 | 1/20 | 0.54 |
| ▸ | GAB1 | Q13480 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 2/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.53 |
| ▸ | TACR2 | P21452 | 2/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | SHBG | P04278 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7243687 | 1.00 | ALDH1A1 (0.62) | ALDH1A1PPARGPPARAHSD17B10HPGD | |
| SCHEMBL15881008 | 1.00 | ALDH1A1 (0.62) | ALDH1A1PPARGPPARAHSD17B10HPGD | |
| SCHEMBL26239658 | 0.93 | ALDH1A1 (0.62) | ALDH1A1PPARGPPARAHSD17B10HPGD | |
| SCHEMBL15723417 | 0.89 | ALDH1A1 (0.57) | ALDH1A1HSD17B10HPGDAKT1IRS1 | |
| SCHEMBL31502353 | 0.89 | CYP4A11 (0.57) | ALDH1A1PPARGPPARAHSD17B10HPGD | |
| SCHEMBL10929511 | 0.87 | CYP4Z1 (0.60) | ALDH1A1PPARGPPARAHSD17B10ESR1 | |
| SCHEMBL10798505 | 0.86 | CYP4F2 (0.56) | ALDH1A1HSD17B10HPGDKDM4ELMNA | |
| SCHEMBL6057577 | 0.86 | CYP4F2 (0.59) | ALDH1A1HSD17B10HPGDKDM4ELMNA | |
| SCHEMBL18256354 | 0.85 | HPGD (0.54) | ALDH1A1HPGDLMNATHRATHRB | |
| SCHEMBL28564755 | 0.85 | CYP4Z1 (0.49) | ALDH1A1HSD17B10HPGDAKT1IRS1 |
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-0262399-B1 | CYCLIC ENOL DERIVATIVES, PRODUCTION AND USE THEREOF | Takeda Chemical Industries, Ltd. (JP) | 1993-02-03 | — | — | EP | disclosed |
| US-4925868-A | CARDIOVASCULAR DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-05-15 | — | — | US | disclosed |
| EP-0262399-A2 | Cyclic enol derivatives, production and use thereof | Takeda Chemical Industries, Ltd. (JP) | 1988-04-06 | — | — | EP | disclosed |