Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | PREP | P48147 | 4/20 | 0.39 |
| ▸ | CA12 | O43570 | 4/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | CA9 | Q16790 | 4/20 | 0.35 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | FLT1 | P17948 | 1/20 | 0.33 |
| ▸ | GRK5 | P34947 | 1/20 | 0.33 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5431487 | 0.85 | ALDH1A1 (0.39) | ALDH1A1ESR1CYP3A4ESR2PREP | |
| SCHEMBL5446526 | 0.85 | ALDH1A1 (0.58) | ALDH1A1ESR1CYP3A4ESR2PREP | |
| SCHEMBL197925 | 0.81 | ALDH1A1 (0.45) | ALDH1A1ESR1CYP3A4ESR2KDM4E | |
| SCHEMBL5431483 | 0.79 | PREP (0.39) | ALDH1A1ESR1CYP3A4ESR2PREP | |
| SCHEMBL196300 | 0.79 | PSEN1 (0.46) | ALDH1A1ESR1CYP3A4ESR2HDAC8 | |
| SCHEMBL196285 | 0.79 | ELANE (0.54) | ALDH1A1ESR1CYP3A4ESR2KDM4E | |
| SCHEMBL7122766 | 0.78 | ESR1 (0.65) | ALDH1A1ESR1CYP3A4ESR2CHEK1 | |
| SCHEMBL7123509 | 0.77 | ALDH1A1 (0.41) | ALDH1A1ESR1CYP3A4ESR2KDM4E | |
| SCHEMBL8421115 | 0.77 | ALDH1A1 (0.41) | ALDH1A1ESR1CYP3A4ESR2KDM4E | |
| SCHEMBL8424914 | 0.77 | ALDH1A1 (0.41) | ALDH1A1ESR1CYP3A4ESR2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-6667415-B1 | Dissolution inhibitors; sensitivity, resolution, process-ability; preservation stability | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2003-12-23 | — | — | US | disclosed |
| EP-0646568-B1 | Tertiary butyl 4,4-bis(4'-hydroxyphenyl) pentanoate derivatives and positive resist materials containing the same | SHINETSU CHEMICAL CO (JP) | 1998-12-23 | — | — | EP | disclosed |
| EP-0646568-A2 | Tertiary butyl 4,4-bis(4'-hydroxyphenyl) pentanoate derivatives and positive resist materials containing the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1995-04-05 | — | — | EP | disclosed |