Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.55 |
| ▸ | HTR2B | P41595 | 3/20 | 0.55 |
| ▸ | HTR2C | P28335 | 2/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.49 |
| ▸ | DRD3 | P35462 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.49 |
| ▸ | ACP3 | P15309 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21076021 | 0.79 | HTR2A (0.60) | HTR2AHTR2BHTR2CSIGMAR1ADRA2C | |
| SCHEMBL18739763 | 0.75 | HTR2A (0.64) | HTR2AHTR2BHTR2CSIGMAR1ADRA2C | |
| SCHEMBL18739769 | 0.75 | HTR2A (0.64) | HTR2AHTR2BHTR2CSIGMAR1ADRA2C | |
| SCHEMBL30412479 | 0.73 | HTR2A (0.72) | HTR2AHTR2BHTR2CSIGMAR1ADRA2C | |
| SCHEMBL5706525 | 0.73 | HTR2A (0.72) | HTR2AHTR2BHTR2CSIGMAR1ADRA2C | |
| SCHEMBL5706540 | 0.73 | HTR2A (0.72) | HTR2AHTR2BHTR2CSIGMAR1ADRA2C | |
| SCHEMBL21306789 | 0.73 | HTR2A (0.53) | HTR2AHTR2BHTR2CSIGMAR1ADRA2C | |
| SCHEMBL2421761 | 0.73 | HTR2A (0.72) | HTR2AHTR2BHTR2CSIGMAR1ADRA2C | |
| SCHEMBL28256765 | 0.73 | HTR2A (0.72) | HTR2AHTR2BHTR2CSIGMAR1ADRA2C | |
| SCHEMBL19040919 | 0.73 | HTR2A (0.71) | HTR2AHTR2BHTR2CSIGMAR1ADRA2C |
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-3560920-A1 | SECONDARY ALCOHOL QUINOLINYL MODULATORS OF ROR GAMMA T | Janssen Pharmaceutica NV (BE) | 2019-10-30 | — | — | EP | disclosed |