Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 6/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 6/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 2/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL2583835 | 0.77 | HRH1 (0.56) | HRH1ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL844607 | 0.76 | AOC3 (0.46) | HRH1HTR2ATAAR1 | |
| SCHEMBL22620835 | 0.76 | HRH1 (0.62) | HRH1HTR2ATAAR1DPP4TSHR | |
| SCHEMBL4672668 | 0.76 | HRH1 (0.62) | HRH1HTR2ATAAR1DPP4TSHR | |
| SCHEMBL14767588 | 0.76 | AOC3 (0.46) | HRH1HTR2ATAAR1 | |
| SCHEMBL4890479 | 0.76 | HRH1 (0.39) | HRH1HTR2ATAAR1DPP4F2 | |
| SCHEMBL5189954 | 0.76 | HRH1 (0.62) | HRH1HTR2ATAAR1DPP4TSHR | |
| Hydrochloric Acid SCHEMBL7970943 | 0.74 | HRH1 (0.60) | HRH1HTR2ATAAR1TSHR | |
| SCHEMBL17008844 | 0.73 | HRH1 (0.41) | HRH1ALDH1A1HPGDALOX15ALOX12 | |
| SCHEMBL10846548 | 0.73 | TRPA1 (0.41) | HRH1ALDH1A1HSD17B10HTR2ATAAR1 |
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-2015054476-A1 | C-HALOGEN BOND FORMATION | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2015-04-16 | — | — | WO | disclosed |