Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 7/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1950368 | 1.00 | ABCB1 (0.45) | ABCB1ABCG2MEN1KMT2ADRD2 | |
| SCHEMBL1951288 | 0.94 | ABCB1 (0.45) | ABCB1ABCG2MEN1KMT2ADRD2 | |
| SCHEMBL519769 | 0.91 | ALK (0.44) | ABCB1DRD2HRH3 | |
| SCHEMBL16370737 | 0.88 | NR1H2 (0.37) | ABCB1ABCG2CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL2844326 | 0.86 | CYP1A2 (0.50) | ABCB1MEN1KMT2ADRD2DRD3 | |
| SCHEMBL13102586 | 0.84 | POLB (0.53) | ABCB1MEN1KMT2ADRD2DRD3 | |
| SCHEMBL30561518 | 0.80 | NR1H2 (0.39) | ABCB1ABCG2MEN1KMT2ADRD2 | |
| SCHEMBL20704242 | 0.80 | NR1H2 (0.39) | ABCB1ABCG2MEN1KMT2ADRD2 | |
| SCHEMBL1953020 | 0.80 | DRD2 (0.46) | ABCB1ABCG2DRD2DRD3 | |
| SCHEMBL21412795 | 0.80 | SIGMAR1 (0.59) | DRD2DRD3HRH3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3564232-B1 | BMP-SIGNAL-INHIBITING COMPOUND | RIKEN (JP) | 2022-01-26 | — | — | EP | claimed |
| CN-115515589-A | ULK1/2 inhibitors and methods of use thereof | 萨克生物研究学院 | 2022-12-23 | — | — | CN | disclosed |
| EP-4103182-A1 | INHIBITORS OF ULK1/2 AND METHODS OF USING SAME | Salk Institute for Biological Studies (US) | 2022-12-21 | — | — | EP | disclosed |