Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.46 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.46 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | ACVR1 | Q04771 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | GRM5 | P41594 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22768039 | 0.84 | GRM5 (0.48) | HTTRAB9AKMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL30403363 | 0.82 | GRM5 (0.46) | PIK3CAPIK3CBPIK3CGGRM5CYP1A2 | |
| SCHEMBL30405671 | 0.76 | CYP2A6 (0.41) | CYP2C9CYP2C19CYP2A6CYP2E1CYP2B6 | |
| SCHEMBL16682846 | 0.75 | PDCD1 (0.55) | CYP2C9CYP2C19CYP2A6CYP2E1CYP2B6 | |
| SCHEMBL30405703 | 0.72 | CYP2A6 (0.42) | CYP2C9CYP2C19CYP2A6CYP2E1CYP2B6 | |
| SCHEMBL30405582 | 0.72 | CYP2A6 (0.38) | CYP2C9CYP2C19CYP2A6CYP2E1CYP2B6 | |
| SCHEMBL20456849 | 0.70 | PIK3CD (0.35) | PIK3CAPIK3CBPIK3CGMTOR | |
| SCHEMBL16682671 | 0.70 | KDM4E (0.48) | CYP2A6ALDH1A1LMNAGAACYP3A4 | |
| SCHEMBL29050010 | 0.69 | GRM5 (0.50) | GRM5 | |
| SCHEMBL29514224 | 0.69 | GRM5 (0.50) | GRM5 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116171280-A | Casein kinase 1 delta modulators | 詹森药业有限公司 | 2023-05-26 | — | — | CN | claimed |