Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA4 | P22748 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | SRD5A2 | P31213 | 5/20 | 0.39 |
| ▸ | TDP2 | O95551 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SRD5A1 | P18405 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3712693 | 0.87 | TDP1 (0.46) | ALDH1A1MAPK1CA12CA1CA2 | |
| SCHEMBL5586035 | 0.85 | TSHR (0.47) | ALDH1A1MAPK1KDM4ETSHR | |
| Hydrochloric Acid SCHEMBL10700892 | 0.85 | TDP1 (0.45) | ALDH1A1MAPK1CA12CA1CA2 | |
| SCHEMBL9995987 | 0.72 | TSHR (0.47) | ALDH1A1KDM4ETSHR | |
| SCHEMBL10509462 | 0.72 | NPC1 (0.46) | TDP1KDM4EMAPTPOLBMEN1 | |
| SCHEMBL1246502 | 0.72 | AHR (0.39) | MAPTBLM | |
| SCHEMBL5765610 | 0.71 | ALDH1A1 (0.47) | ALDH1A1MAPK1CA12CA1CA2 | |
| Carbamic Acid SCHEMBL6649969 | 0.71 | HSD17B10 (0.34) | ALDH1A1MAPK1TDP1KDM4EMAPT | |
| SCHEMBL5138970 | 0.70 | ALDH1A1 (0.47) | ALDH1A1MAPK1CA12CA1CA2 | |
| SCHEMBL10974858 | 0.70 | ALDH1A1 (0.46) | ALDH1A1MAPK1CA12CA1CA2 |
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-3411080-A2 | COMPOUNDS AND METHODS OF TREATING RNA-MEDIATED DISEASES | Arrakis Therapeutics, Inc. (US) | 2018-12-12 | — | — | EP | disclosed |
| WO-2017136450-A2 | COMPOUNDS AND METHODS OF TREATING RNA-MEDIATED DISEASES | ARRAKIS THERAPEUTICS, INC. (US) | 2017-08-10 | — | — | WO | disclosed |