Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.51 |
| ▸ | ELOVL1 | Q9BW60 | 4/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | CHI3L1 | P36222 | 1/20 | 0.39 |
| ▸ | CHIT1 | Q13231 | 1/20 | 0.39 |
| ▸ | CHIA | Q9BZP6 | 1/20 | 0.39 |
| ▸ | F2RL1 | P55085 | 2/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22581914 | 0.83 | ADRB1 (0.64) | HRH3ADRB1ALDH1A1 | |
| SCHEMBL3590735 | 0.83 | HRH3 (0.44) | HRH4HRH3ADRB1SMN1; SMN2ALDH1A1 | |
| SCHEMBL30567171 | 0.83 | ADRB1 (0.64) | HRH3ADRB1ALDH1A1 | |
| SCHEMBL31196150 | 0.83 | PIK3CA (0.58) | ELOVL1RAB9ASMN1; SMN2NPC1HTT | |
| SCHEMBL3590738 | 0.83 | HRH4 (0.59) | HRH4HRH3ALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL31061135 | 0.82 | ADRB1 (0.62) | HRH3ADRB1ALDH1A1 | |
| SCHEMBL16333432 | 0.79 | HRH3 (0.42) | HRH4HRH3ADRB1SMN1; SMN2ALDH1A1 | |
| SCHEMBL12093609 | 0.77 | HRH3 (0.57) | HRH4HRH3CHI3L1CHIT1CHIA | |
| SCHEMBL12654054 | 0.76 | HRH4 (0.51) | HRH4ADRB1RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL465754 | 0.76 | GRIN2D (0.57) | HRH4RAB9ASMN1; SMN2ALDH1A1NPC1 |
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-2020109224-A1 | FURTHER HETEROAROMATIC COMPOUNDS HAVING ACTIVITY AGAINST RSV | Janssen Sciences Ireland Unlimited Company (IE) | 2020-06-04 | — | — | WO | disclosed |