Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22239299 | 0.90 | ESR1 (0.43) | HRH3OPRM1OPRD1OPRK1 | |
| SCHEMBL24136437 | 0.90 | ESR1 (0.43) | HRH3OPRM1OPRD1OPRK1 | |
| SCHEMBL22239262 | 0.78 | HRH3 (0.42) | HRH3 | |
| SCHEMBL14549517 | 0.78 | LTA4H (0.64) | HRH3LTA4H | |
| SCHEMBL20683762 | 0.76 | KDM4E (0.46) | LTA4H | |
| SCHEMBL4688942 | 0.75 | SPHK1 (0.61) | — | |
| SCHEMBL16601284 | 0.75 | GRIN2B (0.65) | — | |
| SCHEMBL30076199 | 0.74 | GRIN2B (0.66) | — | |
| SCHEMBL13755814 | 0.73 | SLC6A3 (0.58) | HRH3HTR2ASLC6A3KCNH2 | |
| SCHEMBL28758805 | 0.72 | ESR1 (0.58) | OPRM1OPRD1OPRK1ADRA2APTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3683207-A1 | N-ALKYLARYL-5-OXYARYL-OCTAHYDRO-CYCLOPENTA[C]PYRROLE NEGATIVE ALLOSTERIC MODULATORS OF NR2B | Cadent Therapeutics, Inc. (US) | 2020-07-22 | — | — | EP | disclosed |