Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | PRNP | P04156 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.36 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | CASP1 | P29466 | 2/20 | 0.31 |
| ▸ | CASP7 | P55210 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30762689 | 0.84 | PTGES (0.36) | ALDH1A1 | |
| SCHEMBL30762389 | 0.75 | ALDH1A1 (0.39) | ALDH1A1NPSR1HTTPRNPPPARG | |
| SCHEMBL30762373 | 0.75 | KDM4E (0.46) | ALDH1A1NPSR1HTTPRNPPPARG | |
| SCHEMBL30762620 | 0.74 | KDM4E (0.45) | ALDH1A1NPSR1HTTPRNPPPARG | |
| SCHEMBL30762663 | 0.72 | HTT (0.54) | ALDH1A1HTTKDM4EMAPTCASP1 | |
| SCHEMBL30762498 | 0.72 | HRH4 (0.36) | NPSR1HTTPRNPPPARGNCOA2 | |
| SCHEMBL30762547 | 0.71 | PRNP (0.41) | ALDH1A1NPSR1HTTPRNPPPARG | |
| SCHEMBL30762383 | 0.70 | ALDH1A1 (0.35) | ALDH1A1NPSR1HTTPRNPPPARG | |
| SCHEMBL30762453 | 0.70 | NPSR1 (0.40) | NPSR1HTTPRNPPPARGNCOA2 | |
| SCHEMBL30634862 | 0.68 | PRNP (0.38) | ALDH1A1NPSR1HTTPRNPPPARG |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024026423-A1 | SUBSTITUTED QUINOLINE DERIVATIVES AS PI3K INHIBITORS | BLACK DIAMOND THERAPEUTICS, INC. (US) | 2024-02-01 | — | — | WO | disclosed |