Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
| ▸ | BRS3 | P32247 | 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 | |
|---|---|---|---|---|
| SCHEMBL8361592 | 0.80 | LOXL2 (0.52) | HRH3CYP1A2CYP2D6HRH4LOXL2 | |
| SCHEMBL10463138 | 0.79 | MCHR1 (0.56) | HRH3CYP1A2CYP2D6AOC3DHFR | |
| SCHEMBL10462814 | 0.79 | HRH3 (0.49) | HRH3CYP1A2CYP2D6PPARGPOLB | |
| SCHEMBL2619346 | 0.79 | HRH3 (0.59) | HRH3CYP1A2CYP2D6PPARGPOLB | |
| SCHEMBL19654056 | 0.79 | KDM4E (0.56) | HRH3CYP1A2CYP2D6HRH4POLB | |
| SCHEMBL10461130 | 0.77 | PPARG (0.51) | HRH3CYP1A2CYP2D6PPARGL3MBTL1 | |
| SCHEMBL10462095 | 0.77 | PPARG (0.51) | HRH3CYP1A2CYP2D6DHFRPPARG | |
| SCHEMBL487617 | 0.76 | HRH3 (0.55) | HRH3CYP1A2CYP2D6PPARGPOLB | |
| SCHEMBL30398570 | 0.76 | HRH3 (0.55) | HRH3CYP1A2CYP2D6PPARGPOLB | |
| SCHEMBL22523876 | 0.76 | HRH3 (0.49) | HRH3CYP1A2CYP2D6HTR2AHTR2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3334717-B1 | ARYL-SUBSTITUTED DIHYDROQUINOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS | NEOMED INST (CA) | 2020-07-01 | — | — | EP | disclosed |
| WO-2017024408-A1 | ARYL-SUBSTITUTED DIHYDROQUINOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS | NEOMED INSTITUTE (CA) | 2017-02-16 | — | — | WO | disclosed |