Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | HTR2B | P41595 | 2/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.41 |
| ▸ | PNMT | P11086 | 1/20 | 0.41 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.40 |
| ▸ | PGK1 | P00558 | 1/20 | 0.40 |
| ▸ | PGK2 | P07205 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11789845 | 0.85 | HDAC4 (0.42) | HTR2AHTR2BHTR2CGABRA1GABRB2 | |
| SCHEMBL8539519 | 0.82 | GABRA1 (0.50) | HTR2AHTR2BHTR2CGABRA1GABRB2 | |
| SCHEMBL8792716 | 0.82 | GABRA1 (0.40) | HTR2AHTR2BHTR2CGABRA1GABRB2 | |
| SCHEMBL19557961 | 0.82 | GABRA1 (0.44) | HTR2AHTR2BGABRA1GABRB2PNMT | |
| SCHEMBL8792217 | 0.82 | PNMT (0.44) | HTR2AHTR2BHTR2CGABRA1GABRB2 | |
| SCHEMBL28486515 | 0.82 | GABRA1 (0.40) | HTR2AHTR2BHTR2CGABRA1GABRB2 | |
| SCHEMBL8793457 | 0.82 | GABRA1 (0.44) | HTR2AHTR2BGABRA1GABRB2PNMT | |
| SCHEMBL8792478 | 0.82 | MEN1 (0.47) | HTR2AHTR2BGABRA1GABRB2PNMT | |
| SCHEMBL29967289 | 0.82 | MEN1 (0.47) | HTR2AHTR2BGABRA1GABRB2PNMT | |
| SCHEMBL9336482 | 0.82 | GABRA1 (0.40) | HTR2AGABRA1GABRB2PNMTTAAR1 |
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-2023154291-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-08-17 | — | — | WO | disclosed |