Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 8/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.61 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.61 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.61 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.61 |
| ▸ | HPGD | P15428 | 3/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.61 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.61 |
| ▸ | SCN1A | P35498 | 4/20 | 0.49 |
| ▸ | SCN2A | Q99250 | 4/20 | 0.49 |
| ▸ | SCN3A | Q9NY46 | 4/20 | 0.49 |
| ▸ | CALCRL | Q16602 | 4/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30915540 | 1.00 | CYP2D6 (0.61) | CYP2D6ALDH1A1HSD17B10KCNH2KDM4E | |
| SCHEMBL2760468 | 0.84 | CYP2D6 (0.64) | CYP2D6ALDH1A1HSD17B10KCNH2KDM4E | |
| SCHEMBL14535338 | 0.84 | CYP2D6 (0.64) | CYP2D6ALDH1A1HSD17B10KCNH2KDM4E | |
| SCHEMBL522674 | 0.81 | CYP2D6 (0.63) | CYP2D6ALDH1A1HSD17B10KCNH2KDM4E | |
| SCHEMBL25589182 | 0.77 | CYP2D6 (0.81) | CYP2D6ALDH1A1HSD17B10KCNH2KDM4E | |
| SCHEMBL14595007 | 0.77 | CYP2D6 (0.81) | CYP2D6ALDH1A1HSD17B10KCNH2KDM4E | |
| SCHEMBL25265154 | 0.76 | CYP2D6 (0.80) | CYP2D6ALDH1A1HSD17B10KCNH2KDM4E | |
| SCHEMBL25188332 | 0.76 | CYP2D6 (0.80) | CYP2D6ALDH1A1HSD17B10KCNH2KDM4E | |
| SCHEMBL25209392 | 0.76 | CYP2D6 (0.80) | CYP2D6ALDH1A1HSD17B10KCNH2KDM4E | |
| Hydroquinidine SCHEMBL23509584 | 0.76 | CYP2D6 (1.00) | CYP2D6ALDH1A1HSD17B10KCNH2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-118176183-A | HIF-2 alpha inhibitors and methods of use thereof | 艾库斯生物科学有限公司 | 2024-06-11 | — | — | CN | disclosed |