Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.36 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.36 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.35 |
| ▸ | LPAR5 | Q9H1C0 | 2/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | RNF4 | P78317 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | LIPE | Q05469 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28537445 | 0.82 | TRPM8 (0.38) | CYP3A4CYP1A2CYP2C9CYP2C19HCAR3 | |
| SCHEMBL1726557 | 0.77 | MAPK14 (0.44) | CYP3A4GAACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28540608 | 0.77 | KDM4C (0.32) | KDM4C | |
| SCHEMBL1258201 | 0.76 | CDK8 (0.47) | CYP3A4 | |
| SCHEMBL1259107 | 0.73 | KDM4E (0.39) | CYP3A4GAACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL1259102 | 0.73 | KDM4E (0.39) | CYP3A4GAACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL23368156 | 0.73 | NPC1 (0.47) | SMN1; SMN2RAB9A | |
| SCHEMBL30203116 | 0.73 | NPC1 (0.47) | SMN1; SMN2RAB9A | |
| SCHEMBL1259294 | 0.72 | PDK1 (0.50) | CYP3A4SMN1; SMN2RAB9A | |
| SCHEMBL5579154 | 0.72 | GCK (0.48) | PTK2 |
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-112334460-A | Biaryl ether type quinazoline derivative | 第一三共株式会社 | 2021-02-05 | — | — | CN | disclosed |