Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.62 |
| ▸ | DRD3 | P35462 | 2/20 | 0.62 |
| ▸ | DRD2 | P14416 | 1/20 | 0.62 |
| ▸ | HTR2A | P28223 | 1/20 | 0.62 |
| ▸ | HTR7 | P34969 | 1/20 | 0.62 |
| ▸ | HTR2B | P41595 | 1/20 | 0.62 |
| ▸ | NPC1 | O15118 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | GFER | P55789 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.54 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.54 |
| ▸ | DRD1 | P21728 | 1/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL27710661 | 0.98 | CYP2D6 (0.62) | HTR1ADRD3DRD2HTR2AHTR7 | |
| SCHEMBL8001854 | 0.90 | ALDH1A1 (0.70) | HTR2ACYP2D6KMT2AALDH1A1TSHR | |
| SCHEMBL13069210 | 0.88 | ALDH1A1 (0.73) | HTR2ACYP2D6KMT2AALDH1A1TSHR | |
| SCHEMBL7386723 | 0.87 | DRD2 (0.59) | HTR1ADRD3DRD2HTR2AHTR7 | |
| SCHEMBL4496558 | 0.85 | TSHR (0.76) | HTR1ADRD3DRD2HTR2AHTR2B | |
| SCHEMBL11829762 | 0.85 | DRD2 (0.70) | HTR1ADRD3DRD2HTR2AHTR7 | |
| SCHEMBL11562987 | 0.84 | DRD2 (0.68) | HTR1ADRD3DRD2HTR2AHTR7 | |
| Primaperone SCHEMBL310299 | 0.84 | TSHR (0.74) | HTR1ADRD3DRD2HTR2AHTR2B | |
| SCHEMBL10603564 | 0.83 | ALDH1A1 (0.81) | HTR1ADRD3DRD2HTR2AHTR7 | |
| SCHEMBL7645836 | 0.83 | ALDH1A1 (0.81) | HTR1ADRD3DRD2HTR2AHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101121702-A | Phenoxy indanone derivatives containing alkylamino side-chain, preparation method and use thereof | UNIV ZHEJIANG (CN) | 2008-02-13 | — | — | CN | disclosed |