Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL644191 | 0.86 | POLB (0.42) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL493284 | 0.84 | SIGMAR1 (0.41) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL645172 | 0.84 | ACE (0.41) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL643236 | 0.83 | ACE (0.40) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL642907 | 0.81 | SLC6A3 (0.37) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL644061 | 0.80 | ACE (0.38) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL644331 | 0.80 | ALDH1A1 (0.38) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL644641 | 0.79 | KMT2A (0.41) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL644224 | 0.78 | HTT (0.40) | SIGMAR1TSHRSLC6A3MEN1KMT2A | |
| SCHEMBL646835 | 0.77 | KDM4E (0.34) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR |
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-8119633-B2 | N-{2-[2-(4-benzyl-4-hydroxy-piperidin-1-yl)-2-oxo-ethoxy]-ethyl}-N-ethyl-4-methoxy-2,3,6-trimethyl-phenylsulfonamide; condensing the N-carboxyalkyl phenylsulfonamide with the substituted piperidine; bradykinin receptor antagonists; analgesics; antidiabetics; angiogenesis inhibitors; rheumatic diseases | GRUENENTHAL GMBH (DE) | 2012-02-21 | — | — | US | disclosed |