Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.80 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.80 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.80 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.80 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.80 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.80 |
| ▸ | MAPT | P10636 | 4/20 | 0.80 |
| ▸ | HPGD | P15428 | 4/20 | 0.80 |
| ▸ | TP53 | P04637 | 3/20 | 0.80 |
| ▸ | CASP1 | P29466 | 3/20 | 0.80 |
| ▸ | MEN1 | O00255 | 2/20 | 0.80 |
| ▸ | CASP7 | P55210 | 2/20 | 0.80 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.80 |
| ▸ | GLA | P06280 | 2/20 | 0.80 |
| ▸ | THRB | P10828 | 1/20 | 0.80 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.80 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.80 |
| ▸ | BLM | P54132 | 1/20 | 0.80 |
| ▸ | DRD2 | P14416 | 7/20 | 0.77 |
| ▸ | DRD1 | P21728 | 6/20 | 0.77 |
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 | |
|---|---|---|---|---|
| SCHEMBL29467728 | 1.00 | KDM4E (0.80) | KDM4ECYP2D6CYP3A4HSD17B10ALDH1A1 | |
| SCHEMBL3936482 | 1.00 | KDM4E (0.80) | KDM4ECYP2D6CYP3A4HSD17B10ALDH1A1 | |
| SCHEMBL29506709 | 1.00 | KDM4E (0.80) | KDM4ECYP2D6CYP3A4HSD17B10ALDH1A1 | |
| Bromide SCHEMBL11708330 | 0.99 | KDM4E (0.78) | KDM4ECYP2D6CYP3A4HSD17B10ALDH1A1 | |
| SCHEMBL177988 | 0.89 | ALDH1A1 (1.00) | KDM4ECYP2D6CYP3A4HSD17B10ALDH1A1 | |
| SCHEMBL14029527 | 0.89 | ALDH1A1 (1.00) | KDM4ECYP2D6CYP3A4HSD17B10ALDH1A1 | |
| SCHEMBL11710493 | 0.88 | KDM4E (0.73) | KDM4ECYP2D6CYP3A4HSD17B10ALDH1A1 | |
| Bromide SCHEMBL11709086 | 0.87 | KDM4E (0.71) | KDM4ECYP2D6CYP3A4HSD17B10ALDH1A1 | |
| SCHEMBL2574124 | 0.87 | DRD2 (0.69) | KDM4ECYP2D6CYP3A4HSD17B10ALDH1A1 | |
| SCHEMBL29039788 | 0.87 | ALDH1A1 (0.82) | KDM4ECYP2D6CYP3A4HSD17B10ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023178809-A1 | SYNTHESIS METHOD FOR NUCIFERINE OR DERIVATIVE THEREOF, NUCIFERINE DERIVATIVE AND APPLICATION THEREOF | 华侨大学 | 2023-09-28 | — | — | WO | disclosed |
| WO-2009009083-A1 | R(-)-2-METHOXY-11-HYDROXYAPORPHINE AND DERIVATIVES THEREOF | THE MCLEAN HOSPITAL CORPORATION (US) | 2009-01-15 | — | — | WO | disclosed |