Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 3/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | LTC4S | Q16873 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | IDH2 | P48735 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6506855 | 0.78 | CETP (0.49) | CETPMGLLHTR2AHTR2CHTR2B | |
| SCHEMBL8626864 | 0.78 | CYP3A4 (0.55) | CETPMGLLHTR2AHTR2CHTR2B | |
| SCHEMBL7592350 | 0.77 | TSHR (0.52) | CETPMGLLHTR2AHTR2CHTR2B | |
| SCHEMBL171829 | 0.74 | TSHR (0.48) | CETPMGLLHTR2AHTR2CHTR2B | |
| SCHEMBL30901511 | 0.74 | TSHR (0.48) | CETPMGLLHTR2AHTR2CHTR2B | |
| SCHEMBL17036644 | 0.73 | TSHR (0.44) | CETPMGLLHTR2AHTR2CHTR2B | |
| SCHEMBL13153377 | 0.72 | CETP (0.41) | CETPHTR2AHTR2CHTR2BTSHR | |
| SCHEMBL6290803 | 0.72 | ALDH1A1 (0.52) | CETPMGLLTSHRMAPK1TAAR1 | |
| Hydrochloric Acid SCHEMBL2190046 | 0.72 | TSHR (0.47) | CETPMGLLHTR2AHTR2CHTR2B | |
| SCHEMBL4617153 | 0.71 | CETP (0.43) | CETPHTR2AHTR2CHTR2BTSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3292104-A1 | CYCLOPROPANE CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL USES THEREOF | Astrazeneca AB (SE) | 2018-03-14 | — | — | EP | disclosed |
| WO-2016177845-A1 | CYCLOPROPANE CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL USES THEREOF | ASTRAZENECA AB (SE) | 2016-11-10 | — | — | WO | disclosed |