Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.42 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17840999 | 0.93 | KDM4E (0.49) | HRH3CYP3A4CYP1A2CYP2D6KDM4E | |
| SCHEMBL15995417 | 0.93 | KDM4E (0.49) | HRH3CYP3A4CYP1A2CYP2D6KDM4E | |
| SCHEMBL16861726 | 0.93 | KDM4E (0.49) | HRH3CYP3A4CYP1A2CYP2D6KDM4E | |
| SCHEMBL8705439 | 0.83 | KDM4E (0.53) | CYP3A4CYP1A2CYP2D6KDM4ETSHR | |
| SCHEMBL3310267 | 0.83 | CYP1A2 (0.53) | CYP3A4CYP1A2CYP2D6KDM4ETSHR | |
| SCHEMBL28300325 | 0.82 | KDM4E (0.43) | HRH3CYP3A4CYP1A2CYP2D6KDM4E | |
| SCHEMBL16995185 | 0.81 | IDO1 (0.53) | HRH3CYP3A4CYP1A2CYP2D6KDM4E | |
| SCHEMBL477416 | 0.81 | IDO1 (0.53) | HRH3CYP3A4CYP1A2CYP2D6KDM4E | |
| SCHEMBL1430742 | 0.81 | IDO1 (0.53) | HRH3CYP3A4CYP1A2CYP2D6KDM4E | |
| SCHEMBL477415 | 0.81 | IDO1 (0.53) | HRH3CYP3A4CYP1A2CYP2D6KDM4E |
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-3406612-B1 | CARBOLINE DERIVATIVE SERVING AS BROMODOMAIN INHIBITOR | NINGBO WENDA PHARMA TECH LTD (CN) | 2021-07-21 | — | — | EP | disclosed |