Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 3/20 | 0.32 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
| ▸ | TPH1 | P17752 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18823502 | 0.87 | NUDT1 (0.32) | NUDT1 | |
| SCHEMBL29367593 | 0.87 | NUDT1 (0.33) | NUDT1 | |
| SCHEMBL16319142 | 0.87 | NUDT1 (0.33) | NUDT1 | |
| SCHEMBL16319139 | 0.87 | NUDT1 (0.33) | NUDT1 | |
| SCHEMBL16319140 | 0.87 | NUDT1 (0.33) | NUDT1 | |
| Methyl Alcohol SCHEMBL20520037 | 0.83 | SIGMAR1 (0.40) | CYP1A2CYP3A4KCNH2SIGMAR1 | |
| SCHEMBL28660879 | 0.81 | NUDT1 (0.31) | NUDT1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL20996047 | 0.80 | FFAR4 (0.30) | — | |
| SCHEMBL18795818 | 0.80 | FFAR4 (0.30) | — | |
| SCHEMBL30305379 | 0.79 | HTR2A (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115551352-A | Active compound combinations and fungicide compositions comprising them | 拜耳公司 | 2022-12-30 | — | — | CN | claimed |
| CN-115551352-A | Active compound combinations and fungicide compositions comprising them | 拜耳公司 | 2022-12-30 | — | — | CN | disclosed |