Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.66 |
| ▸ | ACHE | P22303 | 8/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.61 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2778767 | 0.87 | ALDH1A1 (0.61) | ALDH1A1ACHESMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL2783237 | 0.87 | ALDH1A1 (0.69) | ALDH1A1ACHESMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL18274460 | 0.84 | ALDH1A1 (0.59) | ALDH1A1ACHESMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL9162336 | 0.84 | ALDH1A1 (0.83) | ALDH1A1ACHESMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL2784285 | 0.83 | ALDH1A1 (0.71) | ALDH1A1ACHESMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL9168254 | 0.81 | ACHE (0.64) | ALDH1A1ACHESMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL11464268 | 0.81 | ACHE (0.57) | ALDH1A1ACHESMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL1019672 | 0.80 | ALDH1A1 (1.00) | ALDH1A1ACHESMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL18274491 | 0.80 | ALDH1A1 (0.58) | ALDH1A1ACHESMN1; SMN2L3MBTL1KDM4E | |
| SCHEMBL11007040 | 0.79 | ALDH1A1 (0.70) | ALDH1A1ACHESMN1; SMN2L3MBTL1KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2931717-B1 | INDOLE CARBOXAMIDE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2016-12-07 | — | — | EP | disclosed |