Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 1/20 | 0.61 |
| ▸ | HTR2A | P28223 | 4/20 | 0.56 |
| ▸ | HTR2C | P28335 | 2/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | 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 |
| ▸ | CNR1 | P21554 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28901936 | 0.98 | APLNR (0.59) | APLNRHTR2AHTR2CCHRM2CHRM1 | |
| SCHEMBL681333 | 0.86 | ADRA1A (0.64) | HTR2AHTR2CCHRM2CHRM1CHRM3 | |
| SCHEMBL24202101 | 0.82 | HTR2A (0.55) | APLNRHTR2AHTR2CCHRM2CHRM1 | |
| SCHEMBL680457 | 0.81 | APLNR (0.76) | APLNRHTR2AHTR2CCA12CA1 | |
| SCHEMBL29485595 | 0.81 | APLNR (0.76) | APLNRHTR2AHTR2CCA12CA1 | |
| SCHEMBL10754120 | 0.81 | APLNR (0.60) | APLNRHTR2AHTR2CCNR1 | |
| SCHEMBL30107392 | 0.81 | APLNR (0.63) | APLNRHTR2AHTR2CCA12CA1 | |
| SCHEMBL8163718 | 0.81 | HTR2A (0.63) | HTR2AHTR2CPOLBATM | |
| SCHEMBL27499357 | 0.81 | HTR2A (0.54) | APLNRHTR2ACHRM2CHRM1CHRM3 | |
| SCHEMBL145084 | 0.81 | APLNR (0.68) | APLNRHTR2AHTR2CCA12CA1 |
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 6 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-1718629-B1 | Benzopyran compounds useful for the treatment of arrhytmia | NISSAN CHEMICAL IND LTD (JP) | 2012-12-26 | — | — | EP | 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 |