Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CRHBP | P24387 | 1/20 | 0.52 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.51 |
| ▸ | HRH2 | P25021 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.49 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.48 |
| ▸ | PTGIR | P43119 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28531240 | 0.92 | SPHK2 (0.49) | SPHK2MAPK1ALDH1A1CRHBPCRHR2 | |
| Ammonia Solution, Strong SCHEMBL29243400 | 0.88 | SIGMAR1 (0.50) | SPHK2SMN1; SMN2SIGMAR1HRH2HRH3 | |
| SCHEMBL18863005 | 0.84 | SIGMAR1 (0.60) | SIGMAR1HRH2 | |
| SCHEMBL17541954 | 0.84 | SIGMAR1 (0.60) | SIGMAR1HRH2 | |
| SCHEMBL20945190 | 0.82 | SPHK2 (0.76) | SPHK2SIGMAR1 | |
| SCHEMBL17714416 | 0.82 | ALDH1A1 (0.68) | ALDH1A1CRHBPCRHR2SMN1; SMN2SIGMAR1 | |
| SCHEMBL5195704 | 0.81 | SPHK2 (0.52) | SPHK2MAPK1ALDH1A1CRHBPCRHR2 | |
| SCHEMBL27591914 | 0.81 | SIGMAR1 (0.52) | SPHK2SIGMAR1HRH2HRH3HCRTR1 | |
| SCHEMBL11499924 | 0.81 | HRH3 (0.50) | HRH2HRH3 | |
| SCHEMBL11486276 | 0.80 | ALDH1A1 (0.51) | SPHK2MAPK1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4950674-A | Arylalkylheterocyclic amines,N-substituted by aryloxyalkyl group in a method for allergy treatment | A. H. ROBINS COMPANY, INCORPORATED (US) | 1990-08-21 | — | — | US | disclosed |