Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | HTR2B | P41595 | 3/20 | 0.37 |
| ▸ | HTR7 | P34969 | 2/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.35 |
| ▸ | PNMT | P11086 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | GSR | P00390 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL3740795 | 0.74 | NPC1 (0.47) | RAB9ANPC1HTR2BHTR7SRD5A2 | |
| SCHEMBL9420910 | 0.73 | NPC1 (0.50) | RAB9ANPC1HTR2BHTR7SRD5A2 | |
| SCHEMBL21046174 | 0.72 | HTR2B (0.49) | RAB9ANPC1HTR2BHTR7SRD5A2 | |
| SCHEMBL21436821 | 0.72 | NPC1 (0.47) | RAB9ANPC1HTR2BHTR7SRD5A2 | |
| SCHEMBL30533158 | 0.72 | NPC1 (0.47) | RAB9ANPC1HTR2BHTR7SRD5A2 | |
| SCHEMBL21443923 | 0.70 | NPC1 (0.48) | RAB9ANPC1HTR2BHTR7SRD5A2 | |
| SCHEMBL6674901 | 0.70 | PNMT (0.49) | RAB9ANPC1HTR2BHTR7PNMT | |
| SCHEMBL8197052 | 0.70 | HTR7 (0.47) | RAB9ANPC1HTR2BHTR7SRD5A2 | |
| SCHEMBL1567119 | 0.70 | NPC1 (0.50) | RAB9ANPC1HTR2BHTR7SRD5A2 | |
| SCHEMBL21758208 | 0.70 | NPC1 (0.47) | RAB9ANPC1HTR2BHTR7SRD5A2 |
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-2010149688-A2 | ANTITUMORAL COMPOUNDS | PHARMA MAR, S.A. (ES) | 2010-12-29 | — | — | WO | disclosed |