Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22715908 | 1.00 | CYP1A2 (0.39) | CYP1A2CYP2C9CYP2C19KMT2APKM | |
| SCHEMBL30108079 | 0.78 | KMT2A (0.41) | CYP1A2CYP2C9CYP2C19KMT2AHSP90AB1 | |
| SCHEMBL15904101 | 0.78 | KMT2A (0.41) | CYP1A2CYP2C9CYP2C19KMT2AHSP90AB1 | |
| SCHEMBL12712135 | 0.77 | KMT2A (0.38) | CYP1A2CYP2C9CYP2C19KMT2APKM | |
| SCHEMBL11166832 | 0.77 | LMNA (0.39) | CYP1A2CYP2C9CYP2C19KMT2APKM | |
| SCHEMBL1935371 | 0.74 | KMT2A (0.36) | CYP1A2CYP2C9CYP2C19KMT2APKM | |
| SCHEMBL75623 | 0.74 | PDE10A (0.41) | CYP1A2CYP2C9CYP2C19KMT2APKM | |
| SCHEMBL31718366 | 0.72 | LMNA (0.37) | LMNANR1I2AHR | |
| SCHEMBL29350081 | 0.72 | LMNA (0.37) | ALDH1A1LMNANR1I2AHR | |
| SCHEMBL4068928 | 0.72 | LMNA (0.37) | ALDH1A1LMNANR1I2AHR |
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 |