Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14922690 | 1.00 | AR (0.54) | ARCYP1A2HSD17B10ALDH1A1KMT2A | |
| SCHEMBL20439669 | 0.83 | ALDH1A1 (0.61) | ARCYP1A2HSD17B10ALDH1A1KMT2A | |
| SCHEMBL23727631 | 0.81 | KDM4E (0.51) | ARCYP1A2HSD17B10ALDH1A1KMT2A | |
| SCHEMBL23727633 | 0.81 | KDM4E (0.51) | ARCYP1A2HSD17B10ALDH1A1KMT2A | |
| SCHEMBL27273810 | 0.80 | ESR1 (0.46) | CYP1A2HSD17B10ALDH1A1KDM4EGAA | |
| SCHEMBL30970390 | 0.80 | ESR1 (0.46) | CYP1A2HSD17B10ALDH1A1KDM4EGAA | |
| SCHEMBL6111999 | 0.80 | KDM4E (0.54) | ARCYP1A2HSD17B10ALDH1A1KMT2A | |
| SCHEMBL7308321 | 0.80 | KDM4E (0.54) | ARCYP1A2HSD17B10ALDH1A1KMT2A | |
| SCHEMBL30968144 | 0.80 | KDM4E (0.54) | ARCYP1A2HSD17B10ALDH1A1KMT2A | |
| SCHEMBL24162249 | 0.79 | ALDH1A1 (0.46) | ARALDH1A1KDM4EGAAGLA |
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-4149471-A1 | ISOQUINOLINE DERIVATIVES, METHODS OF SYNTHESIS AND USES THEREOF | Prosetta Biosciences, Inc. (US) | 2023-03-22 | — | — | EP | disclosed |