Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | EBP | Q15125 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19701920 | 0.81 | KDM4E (0.36) | KDM4EALDH1A1GAACYP2C9HPGD | |
| SCHEMBL20192243 | 0.81 | KDM4E (0.36) | KDM4EALDH1A1GAACYP2C9HPGD | |
| SCHEMBL1911485 | 0.75 | PDK1 (0.38) | KDM4EALDH1A1GAACYP2C9HPGD | |
| SCHEMBL10130709 | 0.75 | PDK1 (0.38) | KDM4EALDH1A1GAACYP2C9HPGD | |
| SCHEMBL10130710 | 0.75 | PDK1 (0.38) | KDM4EALDH1A1GAACYP2C9HPGD | |
| SCHEMBL104800 | 0.75 | PDK1 (0.38) | KDM4EALDH1A1GAACYP2C9HPGD | |
| SCHEMBL23555055 | 0.74 | EBP (0.37) | KDM4EALDH1A1GAACYP2C9HPGD | |
| SCHEMBL19710606 | 0.74 | EBP (0.37) | KDM4EALDH1A1GAACYP2C9HPGD | |
| SCHEMBL24654733 | 0.71 | KDM4E (0.36) | KDM4EALDH1A1GAACYP2C9HPGD | |
| SCHEMBL21165831 | 0.71 | KDM4E (0.36) | KDM4EALDH1A1GAACYP2C9HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3124482-A1 | QUINOLINE DERIVATIVES AS SMO INHIBITORS | GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) | 2017-02-01 | — | — | EP | disclosed |