Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.44 |
| ▸ | HRH2 | P25021 | 2/20 | 0.44 |
| ▸ | HRH1 | P35367 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 4/20 | 0.41 |
| ▸ | HTR1A | P08908 | 3/20 | 0.41 |
| ▸ | DRD2 | P14416 | 3/20 | 0.41 |
| ▸ | HTR6 | P50406 | 3/20 | 0.41 |
| ▸ | ACHE | P22303 | 4/20 | 0.41 |
| ▸ | BACE1 | P56817 | 4/20 | 0.41 |
| ▸ | BCHE | P06276 | 3/20 | 0.41 |
| ▸ | NAMPT | P43490 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL2577934 | 0.94 | KCNH2 (0.46) | KCNH2HRH3OPRM1OPRK1HRH2 | |
| SCHEMBL7716908 | 0.90 | KDM4E (0.48) | KCNH2HRH3HRH2HRH1HTT | |
| SCHEMBL2547933 | 0.90 | KDM4E (0.48) | KCNH2HRH3HRH2HRH1HTT | |
| SCHEMBL2555109 | 0.90 | KDM4E (0.48) | KCNH2HRH3HRH2HRH1HTT | |
| Hydrochloric Acid SCHEMBL2552428 | 0.89 | KDM4E (0.47) | KCNH2HRH3HRH2HRH1HTT | |
| Hydrochloric Acid SCHEMBL2552429 | 0.89 | KDM4E (0.47) | KCNH2HRH3HRH2HRH1HTT | |
| SCHEMBL2555154 | 0.85 | KDM4E (0.48) | KCNH2HRH3OPRM1OPRK1HTT | |
| SCHEMBL7716923 | 0.83 | SMN1; SMN2 (0.54) | KCNH2HRH3HTTTHRBALDH1A1 | |
| SCHEMBL2554540 | 0.78 | KDM4E (0.47) | KCNH2HRH3HTTHTR7HTR1A | |
| Hydrochloric Acid SCHEMBL9796292 | 0.78 | ALDH1A1 (0.55) | HRH2HRH1HTTTHRBHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011121309-A1 | PHENYL SULFONYL DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-10-06 | — | — | WO | disclosed |
| WO-2011121309-A1 | PHENYL SULFONYL DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-10-06 | — | — | WO | disclosed |