Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.39 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.39 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.39 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.39 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.39 |
| ▸ | CXCL8 | P10145 | 5/20 | 0.39 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.39 |
| ▸ | UGT1A9 | O60656 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | ALB | P02768 | 1/20 | 0.39 |
| ▸ | UGT1A6 | P19224 | 1/20 | 0.39 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31062441 | 0.84 | SUCNR1 (0.44) | SUCNR1AKR1B1PTGS2PTGER1PTGER4 | |
| SCHEMBL9890683 | 0.84 | PTGS2 (0.52) | AKR1B1PTGS2PTGER1PTGER4PTGER3 | |
| SCHEMBL31062516 | 0.78 | PTGDR2 (0.40) | AKR1B1PTGS2PTGER1PTGER4PTGER3 | |
| SCHEMBL31062293 | 0.78 | FFAR4 (0.47) | PTGS2PTGER1PTGER4PTGER3PTGER2 | |
| SCHEMBL31062273 | 0.77 | PTGER1 (0.39) | SUCNR1AKR1B1PTGS2PTGER1PTGER4 | |
| SCHEMBL22798814 | 0.76 | AKR1B1 (0.58) | AKR1B1PTGS2CXCL8AKR1B10UGT1A9 | |
| SCHEMBL30285770 | 0.75 | CXCL8 (0.53) | AKR1B1PTGS2CXCL8AKR1B10UGT1A9 | |
| SCHEMBL17838502 | 0.75 | CXCL8 (0.53) | AKR1B1PTGS2CXCL8AKR1B10UGT1A9 | |
| SCHEMBL9105295 | 0.75 | PTGER1 (0.57) | AKR1B1PTGS2PTGER1PTGER4PTGER3 | |
| SCHEMBL31339486 | 0.75 | AHR (0.42) | ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024168004-A1 | BIARYL AMIDE-CONTAINING AGONISTS OF OREXIN RECEPTOR TYPE 2 | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2024-08-15 | — | — | WO | disclosed |