Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 11/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | AGXT | P21549 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL25955850 | 0.84 | MAOB (0.49) | TAAR1MAOBAGXT | |
| SCHEMBL12496532 | 0.79 | TAAR1 (0.43) | TAAR1MAOBAGXT | |
| SCHEMBL17186265 | 0.78 | TAAR1 (0.52) | TAAR1MAOBAGXTHTR2A | |
| SCHEMBL18554738 | 0.78 | TAAR1 (0.50) | TAAR1MAOB | |
| Hydrochloric Acid SCHEMBL18449679 | 0.77 | TAAR1 (0.50) | TAAR1MAOBAGXTHTR2A | |
| SCHEMBL2773140 | 0.77 | MAOB (0.57) | TAAR1MAOBAGXTHTR2A | |
| SCHEMBL3916729 | 0.74 | TAAR1 (0.53) | TAAR1MAOBHTR2A | |
| SCHEMBL10304837 | 0.73 | TNKS2 (0.45) | AGXT | |
| SCHEMBL14607867 | 0.73 | TAAR1 (0.51) | TAAR1 | |
| SCHEMBL3904438 | 0.72 | TAAR1 (0.55) | TAAR1MAOBHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023126436-A1 | PROCESS FOR PREPARING (5S)-{[2-(4-CARBOXYPHENYL)ETHYL] |2-(2-{|3-CHLORO-4'-(TRIFLUOROMETHYL)BIPHENYL-4- YL]METHOXY}PHENYL)ETHYL]AMINOL-5,6,7,8-TETRAHYDROQUINOLINE-2-CARBOXYLIC ACID AND ITS CRYSTALLINE FORMS FOR USE AS PHARMACEUTICALLY ACTIVE COMPOUND | BAYER AKTIENGESELLSCHAFT (DE) | 2023-07-06 | — | — | WO | disclosed |