Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | PNMT | P11086 | 2/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 2/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3790918 | 0.82 | DPP4 (0.52) | TAAR1PNMTDPP4HTR7TSHR | |
| SCHEMBL2750595 | 0.82 | CYP1A2 (0.38) | HTR7TSHR | |
| SCHEMBL3785411 | 0.81 | HRH3 (0.50) | TAAR1PNMTNOS3NOS1NOS2 | |
| SCHEMBL29037314 | 0.80 | TAAR1 (0.42) | TAAR1HTR7HTR2A | |
| SCHEMBL28251645 | 0.76 | ALDH1A1 (0.37) | HTR7TSHR | |
| SCHEMBL3786468 | 0.73 | HTR7 (0.50) | TAAR1PNMTHTR7NOS3NOS1 | |
| SCHEMBL7482529 | 0.72 | GABRA1 (0.43) | TAAR1DPP4TSHR | |
| SCHEMBL3790037 | 0.71 | DPP4 (0.52) | TAAR1PNMTDPP4HTR7TSHR | |
| SCHEMBL209278 | 0.71 | DPP4 (0.69) | TAAR1PNMTDPP4HTR7NOS3 | |
| Water SCHEMBL11047752 | 0.71 | TAAR1 (0.62) | TAAR1PNMTDPP4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-110494442-B | Peptide macrocycles and their use in the treatment of bacterial infections | 豪夫迈·罗氏有限公司 | 2023-07-25 | — | — | CN | disclosed |