Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.38 |
| ▸ | DDO | Q99489 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19557306 | 0.83 | ALDH1A1 (0.47) | KDM4EMAPTALDH1A1LOXL2AOC3 | |
| SCHEMBL30559751 | 0.80 | AOC3 (0.48) | KDM4EMAPTALDH1A1LOXL2AOC3 | |
| SCHEMBL3608256 | 0.80 | AOC3 (0.48) | KDM4EMAPTALDH1A1LOXL2AOC3 | |
| SCHEMBL30559750 | 0.80 | AOC3 (0.48) | KDM4EMAPTALDH1A1LOXL2AOC3 | |
| SCHEMBL15791226 | 0.77 | AOC3 (0.45) | KDM4EMAPTALDH1A1LOXL2AOC3 | |
| SCHEMBL7019205 | 0.73 | AOC3 (0.45) | KDM4EMAPTALDH1A1LOXL2AOC3 | |
| Propane SCHEMBL28235813 | 0.71 | KDM4E (0.50) | KDM4EMAPTALDH1A1LOXL2AOC3 | |
| SCHEMBL108061 | 0.68 | LOXL2 (0.64) | KDM4EMAPTALDH1A1LOXL2AOC3 | |
| SCHEMBL29375490 | 0.68 | LOXL2 (0.64) | KDM4EMAPTALDH1A1LOXL2AOC3 | |
| Ethylamine SCHEMBL7693867 | 0.68 | LOXL2 (0.53) | KDM4EMAPTALDH1A1LOXL2AOC3 |
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-2016022624-A9 | SILYLATION OF AROMATIC HETEROCYCLES BY EARTH ABUNDANT TRANSITION-METAL-FREE CATALYSTS | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2016-03-10 | — | — | WO | disclosed |
| WO-2016022624-A1 | SILYLATION OF AROMATIC HETEROCYCLES BY EARTH ABUNDANT TRANSITION-METAL-FREE CATALYSTS | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2016-02-11 | — | — | WO | disclosed |