Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.64 |
| ▸ | GFER | P55789 | 2/20 | 0.64 |
| ▸ | PPARG | P37231 | 5/20 | 0.58 |
| ▸ | EGFR | P00533 | 1/20 | 0.57 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | HTR2C | P28335 | 1/20 | 0.54 |
| ▸ | TACR1 | P25103 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | PIM1 | P11309 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6922498 | 0.93 | PPARG (0.66) | HPGDKDM4EALDH1A1GFERPPARG | |
| SCHEMBL7242395 | 0.87 | PPARG (0.61) | HPGDKDM4EALDH1A1GFERPPARG | |
| SCHEMBL31006355 | 0.82 | EGFR (0.60) | KDM4EALDH1A1PPARGEGFRTACR1 | |
| SCHEMBL22118483 | 0.82 | EGFR (0.60) | KDM4EALDH1A1PPARGEGFRTACR1 | |
| SCHEMBL6929315 | 0.81 | KDM4E (0.69) | HPGDKDM4EALDH1A1GFERPPARG | |
| SCHEMBL4814649 | 0.80 | PPARG (0.67) | HPGDKDM4EALDH1A1GFERPPARG | |
| SCHEMBL7238606 | 0.80 | PPARG (0.55) | HPGDKDM4EALDH1A1GFERPPARG | |
| SCHEMBL6926495 | 0.79 | PPARG (0.60) | HPGDKDM4EALDH1A1PPARGEGFR | |
| SCHEMBL6624875 | 0.79 | KDM4E (0.68) | KDM4EALDH1A1PPARGEGFRHTR2A | |
| SCHEMBL6929600 | 0.78 | PPARG (0.66) | KDM4EALDH1A1PPARGEGFRTACR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000051984-A1 | 2-ARYL INDOLE DERIVATIVES AS ANTAGONISTS OF TACHYKININS | MERCK SHARP & DOHME LIMITED (GB) | 2000-09-08 | — | — | WO | disclosed |