Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.38 |
| ▸ | DCK | P27707 | 3/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21706024 | 0.78 | ALDH1A1 (0.35) | ALDH1A1KDM4ETDP1SUV39H2GAA | |
| SCHEMBL21682856 | 0.78 | ALDH1A1 (0.44) | ALDH1A1KDM4ETDP1SUV39H2GAA | |
| SCHEMBL21706108 | 0.77 | ALDH1A1 (0.38) | ALDH1A1KDM4ETDP1SUV39H2GAA | |
| SCHEMBL21706120 | 0.76 | GCK (0.41) | ALDH1A1KDM4EGAAMAPTHPGD | |
| SCHEMBL18330519 | 0.72 | SUV39H2 (0.44) | ALDH1A1SUV39H2PIK3CDPIK3CAPIK3CB | |
| SCHEMBL21682879 | 0.71 | POLQ (0.56) | ALDH1A1KDM4EGAAMAPTPOLB | |
| SCHEMBL15507834 | 0.71 | ALDH1A1 (0.54) | ALDH1A1TDP1SUV39H2PIK3CDPIK3CA | |
| SCHEMBL21717773 | 0.69 | GCK (0.41) | ALDH1A1SUV39H2PIK3CDPIK3CAPIK3CB | |
| SCHEMBL16437271 | 0.69 | SUV39H2 (0.40) | ALDH1A1SUV39H2MAPTSMN1; SMN2HPGD | |
| SCHEMBL17548211 | 0.68 | SUV39H2 (0.46) | SUV39H2PIK3CDPIK3CAPIK3CBPIK3CG |
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-2020030924-A1 | THIAZOLEUREAS AS ANTICANCER AGENTS | ARTIOS PHARMA LIMITED (GB) | 2020-02-13 | — | — | WO | disclosed |