Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH2 | P05091 | 1/20 | 0.74 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.72 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.72 |
| ▸ | HPGD | P15428 | 8/20 | 0.72 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.72 |
| ▸ | AR | P10275 | 2/20 | 0.70 |
| ▸ | IGLV6-57 | P01721 | 3/20 | 0.63 |
| ▸ | GLA | P06280 | 2/20 | 0.63 |
| ▸ | GAA | P10253 | 2/20 | 0.63 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL20537229 | 0.85 | KDM4E (0.78) | ALDH2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL31281633 | 0.84 | KDM4E (1.00) | ALDH2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL14176760 | 0.84 | KDM4E (1.00) | ALDH2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL18917474 | 0.82 | ALDH1A1 (0.76) | ALDH2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL27788739 | 0.80 | ALDH1A1 (0.77) | ALDH2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL22501552 | 0.80 | KDM4E (0.74) | ALDH2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL15510532 | 0.79 | KDM4E (0.67) | ALDH1A1KDM4EHPGDHSD17B10GLA | |
| SCHEMBL3210418 | 0.78 | ALDH1A1 (0.79) | ALDH2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL7917973 | 0.77 | ALDH1A1 (0.69) | ALDH2ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL24589862 | 0.77 | IGLV6-57 (1.00) | ALDH2ALDH1A1KDM4EHPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0973936-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998046786-A1 | COMBINATORIAL LIBRARIES OF PEPTIDOMIMETIC AMINOTHIOETHER ACIDS | ELI LILLY AND COMPANY (US) | 1998-10-22 | — | — | WO | disclosed |