Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 16/20 | 0.44 |
| ▸ | DAO | P14920 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30761205 | 0.76 | DPYD (0.42) | NOTUMDAO | |
| SCHEMBL10801923 | 0.73 | DAO (0.34) | NOTUMDAO | |
| SCHEMBL30884517 | 0.72 | DAO (0.39) | DAOCYP1A2ADRA1A | |
| SCHEMBL30565109 | 0.70 | GRIN2D (0.40) | DAOCYP1A2ADRA1A | |
| SCHEMBL10799082 | 0.69 | ALDH1A1 (0.34) | NOTUMDAO | |
| SCHEMBL10801465 | 0.69 | ALDH1A1 (0.34) | NOTUMDAO | |
| SCHEMBL6988660 | 0.68 | KDM4E (0.34) | DAO | |
| SCHEMBL5143967 | 0.68 | DAO (0.38) | NOTUMDAOHTR3A | |
| SCHEMBL27817597 | 0.67 | NOTUM (0.67) | NOTUMCYP1A2CYP2C9CHRNB2CYP2B6 | |
| SCHEMBL7427377 | 0.67 | TYMP (0.38) | DAOCYP1A2ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| US-4725607-A | MITICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-02-16 | — | — | US | disclosed |
| EP-0216541-A1 | Aryl pyridones | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-04-01 | — | — | EP | disclosed |