Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 3/20 | 0.56 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.56 |
| ▸ | HTR2A | P28223 | 2/20 | 0.55 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | HTR2B | P41595 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | APLNR | P35414 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11424531 | 0.86 | ADRA1A (0.70) | ADRA1AADRA2AHTR2AHTR2CHTR2B | |
| SCHEMBL10172021 | 0.84 | CA12 (0.50) | ADRA1AADRA2AHTR2ACA12CA1 | |
| SCHEMBL11077851 | 0.84 | ADRA1A (0.57) | ADRA1AADRA2AHTR2ACA12CA1 | |
| SCHEMBL7002647 | 0.84 | ADRA1A (0.57) | ADRA1AADRA2AHTR2ACA12CA1 | |
| SCHEMBL12606793 | 0.84 | CA12 (0.50) | ADRA1AADRA2AHTR2ACA12CA1 | |
| SCHEMBL11437277 | 0.84 | CA12 (0.50) | ADRA1AADRA2AHTR2ACA12CA1 | |
| SCHEMBL18995540 | 0.82 | CA12 (0.48) | ADRA1AADRA2AHTR2ACA12CA1 | |
| SCHEMBL11658602 | 0.82 | ADRA1A (0.56) | ADRA1AADRA2AHTR2ACA12CA1 | |
| SCHEMBL7153263 | 0.82 | ADRA1A (0.75) | ADRA1AADRA2ACA12CA1CA2 | |
| SCHEMBL14655824 | 0.81 | ADRA1A (0.54) | ADRA1AADRA2AHTR2AHTR2CHTR2B |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017066488-A1 | TREATING PAIN USING A COMPOSITION COMPRISING AN OPIOID AND AN ANTIEMETIC | CHARLESTON LABORATORIES, INC. (US) | 2017-04-20 | — | — | WO | disclosed |
| EP-3129028-A1 | PHARMACEUTICAL COMPOSITIONS | Charleston Laboratories, Inc. (US) | 2017-02-15 | — | — | EP | disclosed |
| WO-2015157738-A1 | PHARMACEUTICAL COMPOSITIONS | CHARLESTON LABORATORIES, INC. (US) | 2015-10-15 | — | — | WO | disclosed |
| EP-2451274-A1 | PHARMACEUTICAL COMPOSITIONS | Charleston Laboratories Inc. (US) | 2012-05-16 | — | — | EP | disclosed |
| WO-2011006012-A1 | PHARMACEUTICAL COMPOSITIONS | CHARLESTON LABORATORIES INC. (US) | 2011-01-13 | — | — | WO | disclosed |