Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1F | O60840 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.39 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3623072 | 0.85 | OPRM1 (0.40) | ALDH1A1KDM4EGAANPC1RAB9A | |
| SCHEMBL28676525 | 0.79 | CACNA1F (0.35) | CACNA1FABCB1CACNA1DCACNA1SCACNA1C | |
| SCHEMBL10442548 | 0.76 | TSHR (0.35) | ALDH1A1KDM4EGAAALOX5NPC1 | |
| SCHEMBL9852431 | 0.72 | TSHR (0.43) | ALDH1A1KDM4EMAPK1LMNATP53 | |
| SCHEMBL10589794 | 0.72 | MAPT (0.39) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL2543218 | 0.71 | POLB (0.34) | MEN1KMT2AOPRM1OPRD1SMN1; SMN2 | |
| SCHEMBL28757628 | 0.71 | TSHR (0.41) | ALDH1A1MEN1KMT2AOPRM1OPRD1 | |
| SCHEMBL1966610 | 0.71 | OPRM1 (0.41) | ALDH1A1KDM4EGAANPC1RAB9A | |
| SCHEMBL28667025 | 0.70 | RET (0.33) | CACNA1FABCB1CACNA1DCACNA1SCACNA1C | |
| SCHEMBL27694521 | 0.70 | CYP3A4 (0.39) | CACNA1DALDH1A1KDM4EGAAMAPT |
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-115246856-A | Retinoic acid receptor agonist, preparation method, intermediate, pharmaceutical composition and application thereof | 上海旭成医药科技有限公司 | 2022-10-28 | — | — | CN | disclosed |