Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.45 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.45 |
| ▸ | CACNA2D1 | P54289 | 7/20 | 0.44 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.43 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NSD2 | O96028 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14251166 | 0.79 | KCNA3 (0.61) | KCNA3LMNACYP3A4CYP2D6CYP1A2 | |
| SCHEMBL94801 | 0.79 | KCNA3 (0.61) | KCNA3LMNACYP3A4CYP2D6CYP1A2 | |
| SCHEMBL11144866 | 0.79 | KCNA3 (0.61) | KCNA3LMNACYP3A4CYP2D6CYP1A2 | |
| SCHEMBL10576049 | 0.78 | KCNA3 (0.69) | KCNA3LMNACYP3A4CYP2D6CYP1A2 | |
| SCHEMBL4517253 | 0.77 | KCNA3 (0.56) | KCNA3LMNACYP3A4CYP2D6CYP1A2 | |
| SCHEMBL96699 | 0.76 | KCNA3 (0.67) | KCNA3LMNACYP3A4CYP2D6CYP1A2 | |
| SCHEMBL1545737 | 0.76 | KCNA3 (0.71) | KCNA3LMNACYP3A4CYP2D6CYP1A2 | |
| SCHEMBL10361892 | 0.76 | KCNA3 (0.67) | KCNA3LMNACYP3A4CYP2D6CYP1A2 | |
| SCHEMBL5449325 | 0.76 | KCNA3 (0.67) | KCNA3LMNACYP3A4CYP2D6CYP1A2 | |
| SCHEMBL4328934 | 0.76 | KCNA3 (0.67) | KCNA3LMNACYP3A4CYP2D6CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3558969-A1 | PYRAZOLE DERIVATIVES AS MALT1 INHIBITORS | Janssen Pharmaceutica NV (BE) | 2019-10-30 | — | — | EP | disclosed |
| WO-2018119036-A1 | PYRAZOLE DERIVATIVES AS MALT1 INHIBITORS | JANSSEN BIOTECH, INC. (US) | 2018-06-28 | — | — | WO | disclosed |