Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.52 |
| ▸ | HTR1D | P28221 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.34 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1108477 | 0.80 | TAAR1 (0.50) | HRH3MAOATAAR1 | |
| SCHEMBL1856737 | 0.79 | TP53 (0.41) | HRH3MAOATAAR1ALDH1A1 | |
| SCHEMBL11385118 | 0.79 | DAO (0.49) | MAOATAAR1IDO1 | |
| SCHEMBL27533766 | 0.79 | CYP3A4 (0.52) | HRH3MAOAALDH1A1 | |
| SCHEMBL751765 | 0.79 | DAO (0.44) | MAOATAAR1IDO1ALDH1A1 | |
| SCHEMBL23528212 | 0.79 | DAO (0.44) | MAOATAAR1IDO1CYP1A2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL27287864 | 0.78 | TAAR1 (0.48) | HRH3MAOATAAR1 | |
| SCHEMBL27647887 | 0.78 | TAAR1 (0.43) | HRH3TAAR1IDO1 | |
| SCHEMBL79201 | 0.77 | MAOA (0.47) | MAOA | |
| Biphenyl SCHEMBL27518037 | 0.75 | HRH3 (0.46) | HRH3TAAR1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111212840-B | Heteroaryl compounds as positive allosteric modulators of the muscarinic M1 receptor | 苏文生命科学有限公司 | 2022-07-22 | — | — | CN | disclosed |
| CN-111212840-A | Heteroaryl compounds as positive allosteric modulators of the muscarinic M1 receptor | 苏文生命科学有限公司 | 2020-05-29 | — | — | CN | disclosed |