Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.45 |
| ▸ | IDO1 | P14902 | 3/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | AGXT | P21549 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | CPA1 | P15085 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.34 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.34 |
| ▸ | MIF | P14174 | 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 | |
|---|---|---|---|---|
| SCHEMBL21538889 | 0.87 | TRPA1 (0.40) | TRPA1IDO1LOXL2TAAR1SMN1; SMN2 | |
| SCHEMBL16280734 | 0.80 | TRPA1 (0.46) | TRPA1IDO1LOXL2TAAR1SMN1; SMN2 | |
| SCHEMBL6444854 | 0.80 | LOXL2 (0.43) | TRPA1IDO1LOXL2TAAR1SMN1; SMN2 | |
| SCHEMBL6443722 | 0.80 | LOXL2 (0.43) | TRPA1IDO1LOXL2TAAR1SMN1; SMN2 | |
| SCHEMBL1061707 | 0.78 | EPHX1 (0.48) | TAAR1MAOBMAOA | |
| SCHEMBL23368181 | 0.77 | LOXL2 (0.45) | TRPA1IDO1LOXL2TAAR1SMN1; SMN2 | |
| SCHEMBL8776657 | 0.77 | TRPA1 (0.43) | TRPA1IDO1LOXL2TAAR1SMN1; SMN2 | |
| SCHEMBL21075947 | 0.76 | TAAR1 (0.45) | IDO1TAAR1MAOBMIF | |
| SCHEMBL31375797 | 0.74 | CPA1 (0.47) | TRPA1SMN1; SMN2CPA1 | |
| SCHEMBL21574645 | 0.73 | TP53 (0.41) | TAAR1ESR1ESR2 |
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 3 patents. 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 |
| EP-3057949-B1 | SECONDARY ALCOHOL QUINOLINYL MODULATORS OF ROR GAMMA T | JANSSEN PHARMACEUTICA NV (BE) | 2019-06-05 | — | — | EP | disclosed |
| EP-2909192-B1 | METHYLENE LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T | JANSSEN PHARMACEUTICA NV (BE) | 2017-05-17 | — | — | EP | disclosed |