Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.43 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.39 |
| ▸ | CARM1 | Q86X55 | 2/20 | 0.39 |
| ▸ | PRMT6 | Q96LA8 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL506593 | 0.86 | ST14 (0.47) | HTR2ASLC6A4ST14L3MBTL1DPP4 | |
| SCHEMBL6680297 | 0.84 | TSHR (0.50) | HTR2ASLC6A4TSHRATML3MBTL1 | |
| SCHEMBL29960384 | 0.84 | TSHR (0.50) | HTR2ASLC6A4TSHRATML3MBTL1 | |
| SCHEMBL7710832 | 0.80 | TSHR (0.57) | HTR2ASLC6A4TSHRATML3MBTL1 | |
| SCHEMBL6061469 | 0.75 | TSHR (0.49) | HTR2ASLC6A4TSHRATML3MBTL1 | |
| SCHEMBL12239008 | 0.74 | HRH1 (0.50) | HTR2ASLC6A4ST14ATML3MBTL1 | |
| SCHEMBL5836321 | 0.74 | HTR2A (0.61) | HTR2ASLC6A4L3MBTL1KDM4EDPP4 | |
| SCHEMBL923365 | 0.74 | HTT (0.70) | SLC6A4ST14TSHRL3MBTL1DPP4 | |
| SCHEMBL507354 | 0.74 | ST14 (0.52) | ST14TSHRATML3MBTL1DPP4 | |
| SCHEMBL190108 | 0.73 | TSHR (0.59) | TSHRATML3MBTL1KDM4ENISCH |
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-2188254-B1 | NOVEL BRADYKININ B1-ANTAGONISTS | BOEHRINGER INGELHEIM INT (DE) | 2012-03-21 | — | — | EP | disclosed |