Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | FBP1 | P09467 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.33 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.33 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.33 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.33 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.33 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 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 | |
|---|---|---|---|---|
| SCHEMBL15864377 | 0.81 | ALDH1A1 (0.39) | CYP1A2SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL31256560 | 0.81 | MEN1 (0.36) | CYP1A2SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL25343294 | 0.81 | MEN1 (0.36) | CYP1A2SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL4362290 | 0.80 | AKR1B1 (0.42) | CYP1A2SMN1; SMN2FBP1MEN1KMT2A | |
| SCHEMBL4362286 | 0.80 | AKR1B1 (0.42) | CYP1A2SMN1; SMN2FBP1MEN1KMT2A | |
| SCHEMBL4720283 | 0.77 | MEN1 (0.37) | SMN1; SMN2MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL28290750 | 0.76 | L3MBTL1 (0.41) | CYP1A2SMN1; SMN2MEN1KMT2AALDH1A1 | |
| SCHEMBL16397785 | 0.75 | GPR35 (0.46) | CYP1A2FBP1MEN1KMT2AALDH1A1 | |
| SCHEMBL6936036 | 0.75 | GPR35 (0.46) | CYP1A2FBP1MEN1KMT2AALDH1A1 | |
| SCHEMBL31256565 | 0.74 | KMT2A (0.37) | SMN1; SMN2MEN1KMT2AALDH1A1GAA |
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-2014106800-A2 | SUBSTITUTED 2-AMINO PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS | AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) | 2014-07-10 | — | — | WO | disclosed |