Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | ACHE | P22303 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18274477 | 0.85 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2ACHEKDM4EHSD17B10 | |
| SCHEMBL2784285 | 0.77 | ALDH1A1 (0.71) | ALDH1A1SMN1; SMN2ACHEL3MBTL1MEN1 | |
| SCHEMBL10749589 | 0.77 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2ACHEL3MBTL1MEN1 | |
| SCHEMBL18274471 | 0.77 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2ACHEL3MBTL1MEN1 | |
| SCHEMBL15797454 | 0.74 | DPP4 (0.47) | ACHEKDM4EJAK2KCNH2MAPT | |
| SCHEMBL2782859 | 0.72 | SLC6A2 (0.52) | ALDH1A1SMN1; SMN2ACHEL3MBTL1MEN1 | |
| SCHEMBL15797453 | 0.72 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2KDM4EKCNH2MAPT | |
| SCHEMBL16995086 | 0.72 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2ACHEL3MBTL1MEN1 | |
| SCHEMBL18274496 | 0.71 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2ACHEL3MBTL1MEN1 | |
| SCHEMBL20036442 | 0.71 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2ACHEL3MBTL1MEN1 |
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 |