Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.47 |
| ▸ | SYNJ2 | O15056 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 6/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | SLC18A3 | Q16572 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9019698 | 1.00 | CYP3A4 (0.48) | CYP3A4KDM4EHSD17B10MAPK1ALDH1A1 | |
| SCHEMBL30775720 | 1.00 | CYP3A4 (0.48) | CYP3A4KDM4EHSD17B10MAPK1ALDH1A1 | |
| SCHEMBL29355417 | 1.00 | CYP3A4 (0.48) | CYP3A4KDM4EHSD17B10MAPK1ALDH1A1 | |
| SCHEMBL460037 | 1.00 | CYP3A4 (0.48) | CYP3A4KDM4EHSD17B10MAPK1ALDH1A1 | |
| SCHEMBL1659938 | 1.00 | CYP3A4 (0.48) | CYP3A4KDM4EHSD17B10MAPK1ALDH1A1 | |
| SCHEMBL30775723 | 1.00 | CYP3A4 (0.48) | CYP3A4KDM4EHSD17B10MAPK1ALDH1A1 | |
| SCHEMBL18746282 | 1.00 | CYP3A4 (0.48) | CYP3A4KDM4EHSD17B10MAPK1ALDH1A1 | |
| SCHEMBL460038 | 1.00 | CYP3A4 (0.48) | CYP3A4KDM4EHSD17B10MAPK1ALDH1A1 | |
| SCHEMBL1659934 | 1.00 | CYP3A4 (0.48) | CYP3A4KDM4EHSD17B10MAPK1ALDH1A1 | |
| SCHEMBL1660720 | 1.00 | CYP3A4 (0.48) | CYP3A4KDM4EHSD17B10MAPK1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024170772-A1 | EPIGALLOCATECHIN-3-GALLATE (EGCG) ANALOGS FOR USE IN THE TREATMENT OF DISEASES IN WHICH AN INCREASE OF NAD+ IS BENEFICIAL SUCH AS GLAUCOMA | MIM NEUROSCIENCES AB (SE) | 2024-08-22 | — | — | WO | claimed |
| WO-2024170772-A1 | EPIGALLOCATECHIN-3-GALLATE (EGCG) ANALOGS FOR USE IN THE TREATMENT OF DISEASES IN WHICH AN INCREASE OF NAD+ IS BENEFICIAL SUCH AS GLAUCOMA | MIM NEUROSCIENCES AB (SE) | 2024-08-22 | — | — | WO | disclosed |
| CN-117658967-A | Preparation method of flavan-3, 4-diol derivative | 朗华生物科学(深圳)有限公司 | 2024-03-08 | — | — | CN | disclosed |