Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 15/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1936445 | 0.80 | PPARG (0.43) | KDM4E | |
| SCHEMBL1937037 | 0.77 | CYP1A2 (0.44) | KDM4EALDH1A1 | |
| SCHEMBL20425505 | 0.76 | CYP1A2 (0.42) | MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL4072987 | 0.76 | CYP1A2 (0.42) | MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL28432379 | 0.75 | CYP1A2 (0.62) | MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL1935051 | 0.74 | ADRB2 (0.43) | KMT2AKDM4EALDH1A1 | |
| SCHEMBL1936238 | 0.74 | HRH3 (0.60) | HRH3ALDH1A1 | |
| SCHEMBL28802707 | 0.72 | HRH3 (0.57) | HRH3ALDH1A1 | |
| SCHEMBL5512244 | 0.72 | HRH3 (0.52) | HRH3KDM4EALDH1A1 | |
| SCHEMBL6223200 | 0.70 | HRH3 (0.61) | HRH3KDM4EALDH1A1 |
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-2331518-A1 | NEW BRADYKININ B1 ANTAGONISTS | Evotec AG (DE) | 2011-06-15 | — | — | EP | disclosed |