Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | AR | P10275 | 4/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11224505 | 0.78 | HTR2C (0.41) | HTR2CHTR2AHTR2BARCYP3A4 | |
| SCHEMBL29484307 | 0.77 | HTR2C (0.56) | MEN1KMT2AHTR2CHTR2BHTR1A | |
| SCHEMBL457401 | 0.77 | HTR2C (0.56) | MEN1KMT2AHTR2CHTR2BHTR1A | |
| SCHEMBL29589456 | 0.77 | HTR2C (0.56) | MEN1KMT2AHTR2CHTR2BHTR1A | |
| SCHEMBL11234509 | 0.77 | HTR2C (0.41) | HTR2CARCYP3A4KCNH2CYP2C19 | |
| SCHEMBL11239231 | 0.77 | HTR2C (0.41) | HTR2CARCYP3A4KCNH2CYP2C19 | |
| Hydrochloric Acid SCHEMBL31444282 | 0.76 | HTR2C (0.57) | MEN1KMT2AHTR2CHTR2AHTR2B | |
| Hydrochloric Acid SCHEMBL6092900 | 0.76 | HTR2C (0.57) | MEN1KMT2AHTR2CHTR2AHTR2B | |
| SCHEMBL932518 | 0.74 | MEN1 (0.39) | MEN1KMT2AHTR2CHTR2AKCNH2 | |
| SCHEMBL454693 | 0.74 | MEN1 (0.39) | MEN1KMT2AHTR2CHTR2AKCNH2 |
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-105061326-A | Pyridazinone derivatives as well as preparation method and application thereof | SICHUAN BAILI PHARMACEUTICAL CO LTD | 2015-11-18 | — | — | CN | disclosed |