Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 3/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | AGXT | P21549 | 1/20 | 0.35 |
| ▸ | DBH | P09172 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28597419 | 0.78 | HRH3 (0.40) | IDO1TAAR1HTR2ACAPN1ALDH1A1 | |
| SCHEMBL28201452 | 0.78 | SMN1; SMN2 (0.38) | TAAR1CAPN1ALDH1A1LMNACYP2A6 | |
| SCHEMBL29691485 | 0.78 | DAO (0.42) | DAOIDO1TAAR1CAPN1MAPT | |
| SCHEMBL1106684 | 0.78 | IDO1 (0.58) | DAOIDO1TAAR1SLC6A4SLC6A2 | |
| SCHEMBL4537744 | 0.77 | CALM1 (0.57) | DAOTAAR1LTA4HCAPN1MEN1 | |
| SCHEMBL27832764 | 0.76 | DAO (0.49) | DAOIDO1TAAR1LTA4HAGXT | |
| Hydrochloric Acid SCHEMBL27693313 | 0.76 | CALM1 (0.55) | DAOTAAR1LTA4HCAPN1MEN1 | |
| SCHEMBL28189567 | 0.74 | LTA4H (0.57) | IDO1TAAR1LTA4HAGXTALDH1A1 | |
| SCHEMBL27851105 | 0.69 | DAO (0.44) | DAOIDO1TAAR1MAPTLMNA | |
| SCHEMBL8992968 | 0.69 | IDO1 (0.48) | DAOIDO1TAAR1SLC6A4SLC6A2 |
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-113166160-B | Pyrrolopyridazine derivatives as modulators of the positive allosteric of the muscarinic M1 receptor | 苏文生命科学有限公司 | 2023-12-19 | — | — | CN | disclosed |
| CN-113166160-A | Pyrrolopyridazine derivatives as positive allosteric modulators of muscarinic M1 receptors | 苏文生命科学有限公司 | 2021-07-23 | — | — | CN | disclosed |