Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 6/20 | 0.47 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | DRD1 | P21728 | 2/20 | 0.32 |
| ▸ | HRH1 | P35367 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | THPO | P40225 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | SCN1A | P35498 | 1/20 | 0.32 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL364472 | 0.86 | GPBAR1 (0.49) | GPBAR1HTR2ACYP19A1SLC6A3SLC6A2 | |
| SCHEMBL10240912 | 0.86 | GPBAR1 (0.49) | GPBAR1HTR2ACYP19A1SLC6A3SLC6A2 | |
| SCHEMBL1389558 | 0.86 | GPBAR1 (0.49) | GPBAR1HTR2ACYP19A1SLC6A3SLC6A2 | |
| SCHEMBL368976 | 0.80 | GPBAR1 (0.70) | GPBAR1HTR2ACYP19A1SLC6A3SLC6A2 | |
| SCHEMBL368974 | 0.80 | GPBAR1 (0.70) | GPBAR1HTR2ACYP19A1SLC6A3SLC6A2 | |
| SCHEMBL368975 | 0.80 | GPBAR1 (0.70) | GPBAR1HTR2ACYP19A1SLC6A3SLC6A2 | |
| SCHEMBL365184 | 0.77 | GPBAR1 (0.46) | GPBAR1HTR2ACYP19A1SLC6A3SLC6A2 | |
| SCHEMBL1389631 | 0.77 | GPBAR1 (0.46) | GPBAR1HTR2ACYP19A1SLC6A3SLC6A2 | |
| SCHEMBL1389633 | 0.77 | GPBAR1 (0.46) | GPBAR1HTR2ACYP19A1SLC6A3SLC6A2 | |
| SCHEMBL1389706 | 0.75 | GPBAR1 (0.61) | GPBAR1HTR2ASLC6A3SLC6A2SLC6A4 |
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-2593426-B1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | HOFFMANN LA ROCHE (CH) | 2014-08-20 | — | — | EP | disclosed |