Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | RECQL | P46063 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.42 |
| ▸ | RELA | Q04206 | 2/20 | 0.42 |
| ▸ | XDH | P47989 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | FUT7 | Q11130 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21438369 | 0.84 | ALDH1A1 (0.43) | ALDH1A1MAPTRECQLKDM4ECA12 | |
| SCHEMBL21437544 | 0.84 | ALDH1A1 (0.43) | ALDH1A1MAPTRECQLKDM4ECA12 | |
| SCHEMBL23616930 | 0.81 | CA12 (0.42) | ALDH1A1MAPTRECQLKDM4ECA12 | |
| SCHEMBL23617283 | 0.81 | TTR (0.44) | ALDH1A1KDM4ECA12CA1CA2 | |
| SCHEMBL23617312 | 0.78 | MAOA (0.52) | ALDH1A1MAPTKDM4EGAAPPARA | |
| SCHEMBL23617248 | 0.77 | PTGER1 (0.39) | ALDH1A1MAPTKDM4ECA12CA1 | |
| Heptane SCHEMBL21545217 | 0.76 | ESR1 (0.46) | ALDH1A1MAPTRECQLKDM4EMAOA | |
| SCHEMBL952616 | 0.75 | KDM4E (0.44) | ALDH1A1MAPTRECQLKDM4ECA12 | |
| SCHEMBL23616848 | 0.74 | KDM4E (0.36) | ALDH1A1MAPTRECQLKDM4ECA12 | |
| SCHEMBL2605591 | 0.73 | CA1 (0.60) | ALDH1A1MAPTKDM4ECA12CA1 |
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-3939658-A1 | SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS | Biocryst Pharmaceuticals, Inc. (US) | 2022-01-19 | — | — | EP | disclosed |
| EP-3687506-B1 | SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS | BIOCRYST PHARM INC (US) | 2021-07-07 | — | — | EP | disclosed |