Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | RARA | P10276 | 2/20 | 0.36 |
| ▸ | RARB | P10826 | 2/20 | 0.36 |
| ▸ | RARG | P13631 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.33 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | VDR | P11473 | 1/20 | 0.32 |
| ▸ | IGF1R | P08069 | 1/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22644229 | 0.85 | RARA (0.39) | RARARARBRARGGAAMEN1 | |
| SCHEMBL24559482 | 0.84 | RARB (0.41) | RARARARBRARGGAAMEN1 | |
| SCHEMBL15046513 | 0.79 | RARA (0.43) | RARARARBRARGALDH1A1MEN1 | |
| SCHEMBL24559663 | 0.76 | RARB (0.36) | RARARARBRARGGAAALDH1A1 | |
| SCHEMBL22635921 | 0.76 | RARA (0.35) | RARARARBRARGGAAALDH1A1 | |
| SCHEMBL24559474 | 0.76 | RARA (0.35) | RARARARBRARGGAAALDH1A1 | |
| SCHEMBL22644213 | 0.76 | PPARG (0.33) | RARARARBRARGALDH1A1HTR2C | |
| SCHEMBL29240603 | 0.76 | PPARG (0.33) | RARARARBRARGALDH1A1HTR2C | |
| SCHEMBL22644230 | 0.76 | RARA (0.35) | RARARARBRARGGAAALDH1A1 | |
| SCHEMBL24559483 | 0.76 | APP (0.36) | RARARARBRARGHTR2CIDO1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020225270-A1 | DIAMONDOID COMPOUNDS | MERCK PATENT GMBH (DE) | 2020-11-12 | — | — | WO | disclosed |