Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.38 |
| ▸ | HTR1A | P08908 | 4/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | HTR1D | P28221 | 2/20 | 0.35 |
| ▸ | HTR1B | P28222 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5159996 | 0.82 | PTGDR2 (0.58) | PTGDR2SLC6A2SLC6A4HTR1ASLC6A3 | |
| SCHEMBL42935 | 0.82 | PTGDR2 (0.58) | PTGDR2SLC6A2SLC6A4HTR1ASLC6A3 | |
| SCHEMBL2352902 | 0.82 | PTGDR2 (0.58) | PTGDR2SLC6A2SLC6A4HTR1ASLC6A3 | |
| SCHEMBL2352942 | 0.81 | PTGDR2 (0.56) | PTGDR2SLC6A2SLC6A4HTR1ASLC6A3 | |
| SCHEMBL32679684 | 0.79 | AKR1C1 (0.45) | SLC6A2SLC6A4SLC6A3MEN1KMT2A | |
| SCHEMBL32679674 | 0.79 | AKR1C1 (0.45) | SLC6A2SLC6A4SLC6A3MEN1KMT2A | |
| SCHEMBL556975 | 0.79 | AKR1C1 (0.45) | SLC6A2SLC6A4SLC6A3MEN1KMT2A | |
| SCHEMBL5160288 | 0.79 | AKR1C1 (0.45) | SLC6A2SLC6A4SLC6A3MEN1KMT2A | |
| SCHEMBL9997758 | 0.78 | PTGDR2 (0.55) | PTGDR2SLC6A2SLC6A4HTR1ASLC6A3 | |
| SCHEMBL16843098 | 0.77 | AKR1C1 (0.47) | SLC6A2SLC6A4SLC6A3DRD3KCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1268417-A1 | METHOD FOR PRODUCING AROMATIC ALCOHOLS, ESPECIALLY PHENOL | Degussa AG (DE) | 2003-01-02 | — | — | EP | disclosed |
| WO-2001074767-A1 | METHOD FOR PRODUCING AROMATIC ALCOHOLS, ESPECIALLY PHENOL | DEGUSSA AG (DE) | 2001-10-11 | — | — | WO | disclosed |