Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 3/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | ADCY8 | P40145 | 1/20 | 0.34 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 5/20 | 0.34 |
| ▸ | HTR2C | P28335 | 3/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | HTR1E | P28566 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PTPRB | P23467 | 1/20 | 0.33 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL18272005 | 0.93 | NOTUM (0.41) | SLC9A1KCNH2NOTUMHTR2AHTR2C | |
| SCHEMBL23099892 | 0.78 | NOTUM (0.45) | SLC9A1KCNH2NOTUMHTR2AHTR2C | |
| SCHEMBL11705549 | 0.78 | KDM4E (0.38) | CYP3A4CYP2C9CYP2C19PTGDR2NUDT1 | |
| SCHEMBL16736696 | 0.77 | NUDT1 (0.38) | HTR2ACYP3A4CYP2C9CYP2C19OPRL1 | |
| SCHEMBL10388447 | 0.77 | NUDT1 (0.38) | CYP3A4CYP2C9CYP2C19PTGDR2NUDT1 | |
| SCHEMBL30573139 | 0.77 | ALDH1A1 (0.40) | GAATDP1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL18272019 | 0.77 | ALDH1A1 (0.40) | GAATDP1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL68884 | 0.77 | NUDT1 (0.44) | CYP3A4CYP2C9CYP2C19PTGDR2NUDT1 | |
| SCHEMBL18272080 | 0.77 | NOTUM (0.39) | SLC9A1KCNH2NOTUMHTR2AHTR2C | |
| SCHEMBL14283748 | 0.77 | NUDT1 (0.44) | CYP3A4CYP2C9CYP2C19PTGDR2NUDT1 |
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-2016190871-A1 | 2,5-DIALKYL-4-H/HALO/ETHER-PHENOL COMPOUNDS | TANSNA THERAPEUTICS, INC. (US) | 2016-12-01 | — | — | WO | disclosed |