Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | TTK | P33981 | 1/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.47 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | METAP2 | P50579 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18337425 | 1.00 | CYP1A2 (0.54) | CYP1A2CYP3A4CYP2C19MAPTCASP1 | |
| SCHEMBL84376 | 0.83 | MAPT (0.50) | CYP1A2CYP3A4CYP2C19MAPTCASP1 | |
| SCHEMBL15716504 | 0.82 | CYP1A2 (0.45) | CYP1A2CYP3A4CYP2C19HPGDKMT2A | |
| SCHEMBL8427120 | 0.81 | KMT2A (0.47) | CYP1A2CYP3A4CYP2C19HPGDRAB9A | |
| SCHEMBL10459325 | 0.79 | CYP1A2 (0.48) | CYP1A2CYP3A4CYP2C19MAPTAURKA | |
| SCHEMBL38661825 | 0.79 | CYP1A2 (0.44) | CYP1A2CYP3A4CYP2C19HPGDRAB9A | |
| SCHEMBL27906036 | 0.79 | CYP1A2 (0.44) | CYP1A2CYP3A4CYP2C19HPGDRAB9A | |
| SCHEMBL27889651 | 0.78 | CYP2C19 (0.45) | CYP1A2CYP3A4CYP2C19MAPTHPGD | |
| SCHEMBL7917526 | 0.78 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP2C19HPGDRAB9A | |
| SCHEMBL769495 | 0.78 | CYP1A2 (0.61) | CYP1A2CYP3A4CYP2C19HPGDRAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118908957-A | Small molecule inhibitors of NF- κB induced kinase | 詹森药业有限公司 | 2024-11-08 | — | — | CN | disclosed |
| CN-114222737-B | Small molecule inhibitors of NF- κB induced kinase | 詹森药业有限公司 | 2024-07-26 | — | — | CN | disclosed |
| EP-3976597-A1 | SMALL MOLECULE INHIBITORS OF NF-KB INDUCING KINASE | Janssen Pharmaceutica NV (BE) | 2022-04-06 | — | — | EP | disclosed |
| CN-114222737-A | Small molecule inhibitor of NF-kB induced kinase | 詹森药业有限公司 | 2022-03-22 | — | — | CN | disclosed |