Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | SCN1A | P35498 | 1/20 | 0.37 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.37 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.35 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL613613 | 0.84 | MAPT (0.58) | ALDH1A1KMT2AMAPTPKMATM | |
| SCHEMBL21813827 | 0.79 | CYP1A2 (0.45) | ALDH1A1KMT2AL3MBTL1MAPTPKM | |
| SCHEMBL5234643 | 0.79 | PDK1 (0.42) | ALDH1A1KMT2AL3MBTL1MAPTPKM | |
| SCHEMBL6317855 | 0.78 | ALDH1A1 (0.56) | ALDH1A1KMT2AL3MBTL1MAPTPKM | |
| SCHEMBL4785611 | 0.75 | ALDH1A1 (0.53) | ALDH1A1KMT2AL3MBTL1MAPTPKM | |
| SCHEMBL9098700 | 0.75 | ALDH1A1 (0.53) | ALDH1A1KMT2AL3MBTL1MAPTPKM | |
| SCHEMBL23295963 | 0.74 | ALDH1A1 (0.52) | ALDH1A1KMT2AL3MBTL1MAPTPKM | |
| SCHEMBL15399918 | 0.73 | PDK1 (0.40) | KMT2AL3MBTL1MAPTPOLBCYP1A2 | |
| SCHEMBL25095439 | 0.72 | PDK1 (0.55) | ALDH1A1KMT2AL3MBTL1MAPTPKM | |
| SCHEMBL7902025 | 0.72 | ALDH1A1 (0.71) | ALDH1A1KMT2AL3MBTL1MAPTATM |
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-2010101302-A1 | THIENOPYRIMIDINE AS CDC7 KINASE INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-09-10 | — | — | WO | disclosed |