Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.41 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19574896 | 0.85 | LTB4R (0.44) | HTR2BLTB4RLTB4R2PSMB5DRD2 | |
| SCHEMBL2688677 | 0.85 | LTB4R (0.44) | HTR2BLTB4RLTB4R2PSMB5DRD2 | |
| SCHEMBL8647207 | 0.81 | LTB4R (0.45) | HTR2BLTB4RLTB4R2POLBPSMB5 | |
| SCHEMBL14124137 | 0.81 | LTB4R (0.41) | HTR2BLTB4RLTB4R2PSMB5DRD2 | |
| SCHEMBL6339887 | 0.81 | HTR1A (0.55) | LTB4RLTB4R2PSMB5DRD2DRD3 | |
| Hydrochloric Acid SCHEMBL29960409 | 0.80 | HTR2C (0.54) | HTR2BLTB4RLTB4R2PSMB5DRD2 | |
| Hydrochloric Acid SCHEMBL29960792 | 0.80 | HTR2A (0.45) | LTB4RLTB4R2SLC6A2SLC6A4LTA4H | |
| Hydrochloric Acid SCHEMBL29961237 | 0.80 | HTR2A (0.45) | HTR2BLTB4RLTB4R2POLBESR2 | |
| SCHEMBL6099078 | 0.77 | LTB4R (0.47) | LTB4RLTB4R2POLBPSMB5DRD2 | |
| SCHEMBL506552 | 0.77 | CYP2D6 (0.47) | HTR2BLTB4RLTB4R2PSMB5DRD2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2287161-B1 | Derivatives of 4-piperazin-1-yl-4-benzo[b]thiophene suitable for the treatment of CNS disorders | OTSUKA PHARMA CO LTD (JP) | 2012-05-09 | — | — | EP | disclosed |
| WO-2010128685-A1 | ALPHA HELIX MIMETICS AND METHODS RELATING THERETO | PRISM BIOLAB CORPORATION (JP) | 2010-11-11 | — | — | WO | disclosed |