Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | ACLY | P53396 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.50 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.49 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.49 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.49 |
| ▸ | ERN1 | O75460 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5462328 | 0.95 | ACLY (0.47) | CYP3A4CYP2A6CYP1A2ALDH1A1ACLY | |
| SCHEMBL5462846 | 0.84 | ACLY (0.51) | CYP3A4CYP2A6CYP1A2ALDH1A1ACLY | |
| SCHEMBL5462852 | 0.82 | KDM4E (0.49) | CYP3A4CYP2A6CYP1A2ALDH1A1ACLY | |
| SCHEMBL27802325 | 0.81 | CYP2A6 (0.64) | CYP3A4CYP2A6CYP1A2ALDH1A1CYP2D6 | |
| SCHEMBL18528875 | 0.81 | CYP2A6 (0.52) | CYP3A4CYP2A6CYP1A2ALDH1A1ACLY | |
| SCHEMBL1155472 | 0.79 | CYP2A6 (0.61) | CYP3A4CYP2A6CYP1A2ALDH1A1CYP2D6 | |
| SCHEMBL12381483 | 0.78 | CYP11B1 (0.61) | CYP3A4CYP2A6CYP1A2ALDH1A1CYP2D6 | |
| SCHEMBL1491549 | 0.77 | CYP2A6 (0.64) | CYP3A4CYP2A6CYP1A2ALDH1A1ACLY | |
| SCHEMBL11965538 | 0.76 | CYP2A6 (0.78) | CYP3A4CYP2A6CYP1A2ALDH1A1CYP2D6 | |
| SCHEMBL28674858 | 0.75 | CYP2A6 (0.61) | CYP3A4CYP2A6CYP1A2ALDH1A1CYP2D6 |
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-104974341-A | Cross-linked polyarylether polymer and preparation method thereof | UNIV JILIN | 2015-10-14 | — | — | CN | claimed |
| CN-104974341-A | Cross-linked polyarylether polymer and preparation method thereof | UNIV JILIN | 2015-10-14 | — | — | CN | disclosed |