Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | AKT2 | P31751 | 2/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | ACP3 | P15309 | 1/20 | 0.31 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.31 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.31 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.31 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.31 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.31 |
| ▸ | AKT1 | P31749 | 2/20 | 0.31 |
| ▸ | GSK3B | P49841 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30083604 | 0.79 | TAAR1 (0.50) | CHRNB2CHRNA4SRCTAAR1LOXL2 | |
| SCHEMBL10133262 | 0.79 | TAAR1 (0.50) | CHRNB2CHRNA4SRCTAAR1LOXL2 | |
| SCHEMBL1515909 | 0.76 | ACP3 (0.48) | CHRNB2CHRNA4CA12CA1CA2 | |
| SCHEMBL13368895 | 0.74 | ACP3 (0.47) | CHRNB2CHRNA4TAAR1ACP3MAPK1 | |
| SCHEMBL193931 | 0.70 | CYP2D6 (0.48) | SRCMAPK1 | |
| SCHEMBL17680466 | 0.69 | SYK (0.36) | PRMT5WDR77 | |
| SCHEMBL19784436 | 0.69 | CYP2E1 (0.61) | CHRNB2CHRNA4LOXL2 | |
| SCHEMBL22840001 | 0.69 | ADH1B (0.38) | SRCBACE1CDK2LIPG | |
| SCHEMBL6264168 | 0.68 | SRC (0.41) | SRCLIPG | |
| Hydrochloric Acid SCHEMBL31716379 | 0.68 | ALDH1A1 (0.50) | TAAR1LOXL2PRMT5WDR77MAP4K4 |
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-3484879-B1 | HYDROXYQUINOLINONE COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY | CHIESI FARM SPA (IT) | 2020-12-30 | — | — | EP | disclosed |
| WO-2018011090-A1 | HYDROXYQUINOLINONE COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY | CHIESI FARMACEUTICI S.P.A. (IT) | 2018-01-18 | — | — | WO | disclosed |