Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.49 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 5/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.43 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CASR | P41180 | 1/20 | 0.41 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.40 |
| ▸ | PRKCG | P05129 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | PRKACA | P17612 | 1/20 | 0.40 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21708758 | 0.85 | ROCK2 (0.45) | ROCK2TAS1R3TAS1R1AOC3KCNQ2 | |
| SCHEMBL21708663 | 0.84 | ROCK2 (0.44) | ROCK2AOC3CASRKCNQ2MAPK1 | |
| SCHEMBL21708681 | 0.81 | L3MBTL1 (0.46) | ROCK2MTNR1AMTNR1BL3MBTL1TAS1R3 | |
| SCHEMBL30932899 | 0.81 | L3MBTL1 (0.55) | ROCK2MTNR1AMTNR1BL3MBTL1AOC3 | |
| SCHEMBL28022415 | 0.80 | L3MBTL1 (0.57) | ROCK2MTNR1AMTNR1BL3MBTL1AOC3 | |
| Hydrochloric Acid SCHEMBL5422383 | 0.79 | ROCK2 (0.54) | ROCK2MTNR1AMTNR1BL3MBTL1AOC3 | |
| SCHEMBL29381534 | 0.77 | L3MBTL1 (0.57) | MTNR1AMTNR1BL3MBTL1TAS1R3TAS1R1 | |
| SCHEMBL5181402 | 0.76 | L3MBTL1 (0.56) | ROCK2MTNR1AMTNR1BL3MBTL1AOC3 | |
| SCHEMBL21656313 | 0.76 | L3MBTL1 (0.50) | ROCK2MTNR1AMTNR1BL3MBTL1AOC3 | |
| SCHEMBL21708694 | 0.75 | TAS1R3 (0.37) | TAS1R3TAS1R1KDM4E |
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-3609869-A1 | SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF | Bayer Aktiengesellschaft (DE) | 2020-02-19 | — | — | EP | disclosed |