Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.44 |
| ▸ | TDO2 | P48775 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | CFTR | P13569 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28619873 | 0.79 | CYP11B1 (0.48) | TDO2CYP3A4ALDH1A1CYP1A2CYP2A6 | |
| SCHEMBL20449081 | 0.78 | CYP2A6 (0.53) | TDO2CYP3A4ALDH1A1CYP1A2CYP2A6 | |
| SCHEMBL29202394 | 0.78 | RAB9A (0.47) | PTGS2CYP3A4ALDH1A1CFTRKDM4E | |
| SCHEMBL17336612 | 0.76 | CYP2A6 (0.51) | TDO2CYP3A4ALDH1A1CYP1A2CYP2A6 | |
| SCHEMBL3135642 | 0.73 | CYP11B1 (0.46) | CYP3A4ALDH1A1CYP1A2CYP2A6CYP11B1 | |
| SCHEMBL25222544 | 0.73 | MAP4K4 (0.50) | CYP3A4CA2 | |
| SCHEMBL30112165 | 0.73 | MAP4K4 (0.50) | CYP3A4CA2 | |
| SCHEMBL30627140 | 0.72 | CYP2A6 (0.57) | PTGS2CYP3A4ALDH1A1CYP1A2CYP2A6 | |
| SCHEMBL1927394 | 0.72 | GLA (0.58) | TDO2CYP3A4ALDH1A1CYP1A2CYP2A6 | |
| SCHEMBL15989428 | 0.72 | CYP11B1 (0.53) | TDO2CFTRCYP11B1CYP11B2PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4273146-A1 | TRICYCLIC COMPOUND AND USE THEREOF | Nanjing Zaiming Pharmaceutical Co., Ltd. (CN) | 2023-11-08 | — | — | EP | disclosed |