Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 2/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.40 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL14720777 | 0.88 | MCHR1 (0.44) | SRD5A2MCHR1HRH3HTR2AHTR2C | |
| SCHEMBL14720870 | 0.86 | MCHR1 (0.52) | SRD5A2MCHR1HRH3HTR2AHTR2C | |
| SCHEMBL14720586 | 0.85 | MCHR1 (0.42) | SRD5A2MCHR1HRH3ALDH1A1 | |
| SCHEMBL14720584 | 0.82 | SRD5A2 (0.47) | SRD5A2MCHR1HRH3 | |
| SCHEMBL14720717 | 0.82 | SRD5A2 (0.43) | SRD5A2MCHR1HRH3HTR2AHTR2C | |
| SCHEMBL14720591 | 0.81 | SRD5A2 (0.44) | SRD5A2MCHR1HRH3HTR2AHTR2C | |
| SCHEMBL14720998 | 0.80 | SRD5A2 (0.57) | SRD5A2MCHR1HRH3DHODH | |
| SCHEMBL14720425 | 0.77 | DHODH (0.40) | SRD5A2MCHR1HRH3DHODH | |
| SCHEMBL14721037 | 0.76 | SRD5A2 (0.47) | SRD5A2MCHR1DHODHALDH1A1 | |
| SCHEMBL14721354 | 0.74 | HRH3 (0.47) | SRD5A2HRH3CARM1PRMT6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013027001-A1 | COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-28 | — | — | WO | claimed |
| WO-2013027001-A1 | COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-28 | — | — | WO | disclosed |
| WO-2013027001-A1 | COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-28 | — | — | WO | disclosed |