Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PRSS12 | P56730 | 1/20 | 0.35 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | MELK | Q14680 | 2/20 | 0.34 |
| ▸ | BUB1 | O43683 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 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 | |
|---|---|---|---|---|
| SCHEMBL22258961 | 0.77 | CNR1 (0.47) | POLBKDM4CNAMPT | |
| SCHEMBL22258955 | 0.73 | CYP19A1 (0.33) | MAPK1ALDH1A1CDC7CYP19A1MAPK11 | |
| SCHEMBL31098460 | 0.70 | SMN1; SMN2 (0.47) | TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL22258783 | 0.70 | CSNK1A1 (0.42) | MAPK1ALDH1A1POLBCDC7MAPK14 | |
| SCHEMBL22258956 | 0.64 | ROCK2 (0.44) | MAPK1MELKDYRK1A | |
| SCHEMBL22258664 | 0.64 | CHEK1 (0.57) | MAPK1 | |
| SCHEMBL22258786 | 0.64 | CSNK2A2 (0.48) | DYRK1A | |
| SCHEMBL5946809 | 0.63 | PDK1 (0.44) | PDK1PDK2PDK3PDK4 | |
| SCHEMBL31098537 | 0.63 | ALDH1A1 (0.46) | ALDH1A1KMT2A | |
| SCHEMBL22554282 | 0.63 | PAX8 (0.42) | TSHRALDH1A1MELKMAPK14PAX8 |
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-2020150545-A1 | PYRAZOLE DERIVATIVES AS MODULATORS OF THE WNT/B-CATENIN SIGNALING PATHWAY | SAMUMED, LLC (US) | 2020-07-23 | — | — | WO | disclosed |