Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.53 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.52 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.51 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.51 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.51 |
| ▸ | ADH5 | P11766 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA9 | Q16790 | 2/20 | 0.49 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.49 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.49 |
| ▸ | PORCN | Q9H237 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3990221 | 0.81 | CYP3A4 (0.55) | CYP3A4BAZ2BCYP2D6CYP2C9CYP1A2 | |
| SCHEMBL4757507 | 0.81 | CYP3A4 (0.55) | CYP3A4BAZ2BCYP2D6CYP2C9CYP1A2 | |
| SCHEMBL17315098 | 0.81 | CYP3A4 (0.64) | CYP3A4BAZ2BCYP2D6CYP2C9CYP1A2 | |
| SCHEMBL4661827 | 0.79 | CYP3A4 (0.53) | CYP3A4BAZ2BCYP2D6CYP2C9CYP1A2 | |
| SCHEMBL27814146 | 0.78 | CYP3A4 (0.55) | CYP3A4BAZ2BCYP2D6CYP2C9CYP1A2 | |
| SCHEMBL9451421 | 0.75 | CYP2D6 (0.72) | CYP3A4CYP2D6CYP2C9CYP1A2CYP2C19 | |
| SCHEMBL10512975 | 0.75 | LMNA (0.62) | CYP3A4BAZ2BCYP2D6CYP2C9CYP1A2 | |
| SCHEMBL5647102 | 0.74 | ALDH1A1 (0.62) | CYP3A4BAZ2BCYP2D6CYP2C9CYP1A2 | |
| SCHEMBL1931453 | 0.74 | KMT2A (0.54) | CYP19A1HTT | |
| SCHEMBL2532397 | 0.74 | LMNA (0.78) | CYP3A4BAZ2BCYP2D6CYP2C9CYP1A2 |
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-102127091-B | Heterocyclic ring-containing schiff base compound | TIANJIN INST PHARM RESEARCH | 2012-11-21 | — | — | CN | disclosed |
| CN-102127091-A | Heterocyclic ring-containing schiff base compound | TIANJIN INST PHARM RESEARCH | 2011-07-20 | — | — | CN | disclosed |