Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.38 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.36 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | NAAA | Q02083 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8768332 | 0.88 | TDP1 (0.40) | HTR1AHTR1DHTR1BCXCR1CXCR2 | |
| SCHEMBL8767790 | 0.88 | TDP1 (0.40) | HTR1AHTR1DHTR1BCXCR1CXCR2 | |
| SCHEMBL8767117 | 0.88 | TDP1 (0.40) | HTR1AHTR1DHTR1BCXCR1CXCR2 | |
| SCHEMBL8767787 | 0.86 | HTR1A (0.34) | HTR1AHTR1DHTR1BCXCR1CXCR2 | |
| SCHEMBL8767748 | 0.82 | NFE2L2 (0.44) | HTR1AHTR1DHTR1BHPGDPTGES | |
| SCHEMBL7751379 | 0.81 | NFE2L2 (0.47) | HTR1AHTR1DHTR1BHPGDPTGES | |
| SCHEMBL7745489 | 0.81 | NFE2L2 (0.47) | HTR1AHTR1DHTR1BHPGDPTGES | |
| SCHEMBL8767516 | 0.81 | PDE4A (0.37) | HTR1AHTR1DHTR1BCXCR1CXCR2 | |
| SCHEMBL27553717 | 0.78 | GPR119 (0.34) | HTR1AHTR1DHTR1BCXCR1CXCR2 | |
| SCHEMBL8768450 | 0.78 | GABBR2 (0.42) | HTR1AHTR1DHTR1BHPGDPTGES |
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 |
|---|---|---|---|---|---|---|---|
| EP-0789067-A1 | Cyclopentyl derivatives useful as liquid crystals | Rolic AG (CH) | 1997-08-13 | — | — | EP | disclosed |