Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | WNT1 | P04628 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | TERT | O14746 | 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 | |
|---|---|---|---|---|
| SCHEMBL27185105 | 0.99 | ALDH1A1 (0.42) | ALDH1A1KDM4ETDP1RAB9ANPC1 | |
| SCHEMBL29759947 | 0.99 | ALDH1A1 (0.42) | ALDH1A1KDM4ETDP1RAB9ANPC1 | |
| SCHEMBL29760165 | 0.99 | ALDH1A1 (0.42) | ALDH1A1KDM4ETDP1RAB9ANPC1 | |
| SCHEMBL24577941 | 0.99 | ALDH1A1 (0.42) | ALDH1A1KDM4ETDP1RAB9ANPC1 | |
| SCHEMBL29759935 | 0.98 | ALDH1A1 (0.39) | ALDH1A1KDM4ETDP1RAB9ANPC1 | |
| SCHEMBL24579109 | 0.98 | ALDH1A1 (0.39) | ALDH1A1KDM4ETDP1RAB9ANPC1 | |
| SCHEMBL24577897 | 0.91 | WNT1 (0.39) | ALDH1A1KDM4ETDP1LMNAMAPT | |
| SCHEMBL29759637 | 0.91 | WNT1 (0.39) | ALDH1A1KDM4ETDP1LMNAMAPT | |
| SCHEMBL24577265 | 0.90 | WNT1 (0.37) | WNT1GSK3BDYRK1A | |
| SCHEMBL29759530 | 0.90 | POLB (0.34) | ALDH1A1RAB9ANPC1L3MBTL1SMN1; SMN2 |
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-2022136509-A1 | PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS | ACTELION PHARMACEUTICALS LTD (CH) | 2022-06-30 | — | — | WO | disclosed |