Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 3/20 | 0.44 |
| ▸ | HTR1A | P08908 | 3/20 | 0.43 |
| ▸ | HTR7 | P34969 | 3/20 | 0.43 |
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | HTR5A | P47898 | 1/20 | 0.43 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.42 |
| ▸ | ACVR1 | Q04771 | 2/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.39 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.39 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 3/20 | 0.38 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.38 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | PIM1 | P11309 | 2/20 | 0.37 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.37 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6651306 | 0.81 | HTR6 (0.48) | HTR6HTR1AHTR7HTR2AHTR5A | |
| SCHEMBL4918486 | 0.76 | HTR6 (0.50) | HTR6HTR1AHTR7HTR2AHTR5A | |
| SCHEMBL16599761 | 0.75 | HTR2A (0.39) | HTR6HTR1AHTR7HTR2AHTR5A | |
| SCHEMBL5343209 | 0.72 | HTR7 (0.66) | HTR6HTR1AHTR7HTR2AHTR5A | |
| SCHEMBL16600111 | 0.70 | HTR2A (0.41) | HTR6HTR1AHTR7HTR2AHTR5A | |
| SCHEMBL30556675 | 0.69 | HTR6 (0.58) | HTR6HTR1AHTR7HTR2AHTR5A | |
| Hydrochloric Acid SCHEMBL29176263 | 0.69 | HTR6 (0.49) | HTR6HTR1AHTR7HTR2AHTR5A | |
| SCHEMBL6629133 | 0.66 | HTR6 (0.49) | HTR6HTR1AHTR7HTR2AHTR5A | |
| SCHEMBL17634233 | 0.66 | HTR7 (0.56) | HTR6HTR1AHTR7HTR2AHTR5A | |
| SCHEMBL5193622 | 0.66 | ACVR1 (0.49) | HTR6HTR1AHTR7HTR2AHTR5A |
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-1389194-A2 | INHIBITORS OF BACE | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2004-02-18 | — | — | EP | disclosed |
| WO-2002088101-A2 | INHIBITORS OF BACE | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2002-11-07 | — | — | WO | disclosed |