Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 7/20 | 0.58 |
| ▸ | PRNP | P04156 | 1/20 | 0.52 |
| ▸ | PPARG | P37231 | 1/20 | 0.52 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.52 |
| ▸ | METAP1 | P53582 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | HTR2C | P28335 | 3/20 | 0.43 |
| ▸ | HTR2B | P41595 | 3/20 | 0.43 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4402124 | 1.00 | ACHE (0.58) | ACHEPRNPPPARGNCOR2METAP1 | |
| SCHEMBL11770519 | 0.85 | ACHE (0.55) | ACHEPRNPPPARGNCOR2METAP1 | |
| SCHEMBL10346131 | 0.81 | KDM4E (0.55) | ACHEHTR2AHTR2CHTR2BDRD2 | |
| SCHEMBL14447190 | 0.81 | ACHE (0.50) | ACHEPRNPPPARGNCOR2METAP1 | |
| SCHEMBL20207026 | 0.81 | S100A4 (0.53) | ACHEPRNPPPARGNCOR2HTR2B | |
| SCHEMBL12237089 | 0.79 | ACHE (0.47) | ACHEPRNPPPARGNCOR2METAP1 | |
| SCHEMBL5952596 | 0.79 | HTR1A (0.46) | ACHEPRNPPPARGNCOR2HTR2A | |
| SCHEMBL28461412 | 0.78 | ACHE (0.50) | ACHEPRNPPPARGNCOR2METAP1 | |
| SCHEMBL21294251 | 0.77 | ACHE (0.62) | ACHEPRNPPPARGNCOR2METAP1 | |
| SCHEMBL10752402 | 0.77 | ACHE (0.49) | ACHEMETAP1SIGMAR1CYP19A1KDM4E |
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-1658269-B1 | FUSED COMPOUNDS THAT INHIBIT VANILLOID RECEPTOR SUBTYPE 1 (VR1) RECEPTOR | ABBOTT LAB (US) | 2008-10-22 | — | — | EP | disclosed |