Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 2/20 | 0.38 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | SORD | Q00796 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.33 |
| ▸ | UBE2N | P61088 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29886325 | 0.81 | ALDH1A3 (0.49) | PIK3CAHRH4ADRB1ALDH1A1SMN1; SMN2 | |
| SCHEMBL786129 | 0.81 | ALDH1A3 (0.49) | PIK3CAHRH4ADRB1ALDH1A1SMN1; SMN2 | |
| SCHEMBL19547056 | 0.80 | HRH4 (0.55) | HRH4ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL14232379 | 0.80 | HRH4 (0.50) | PIK3CAHRH4ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL1715756 | 0.77 | PIK3CA (0.57) | PIK3CAALDH1A1SMN1; SMN2KDM4EALDH1A3 | |
| SCHEMBL23048648 | 0.77 | HRH3 (0.45) | HRH4ALDH1A1KDM4EMAPT | |
| SCHEMBL23048714 | 0.77 | HRH3 (0.41) | PIK3CAHRH4ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL1914424 | 0.77 | MAPT (0.48) | HRH4ADRB1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL23048878 | 0.77 | HRH3 (0.42) | — | |
| SCHEMBL23048804 | 0.74 | WNT1 (0.41) | HRH4ALDH1A1POLB |
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-3448386-B1 | ISOQUINOLIN-3-YL CARBOXAMIDES AND PREPARATION AND USE THEREOF | SAMUMED LLC (US) | 2021-03-03 | — | — | EP | disclosed |