Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4250415 | 0.68 | KDM4E (0.39) | KDM4EALDH1A1MAPTTHRB | |
| SCHEMBL10405593 | 0.66 | ALDH1A1 (0.52) | ALDH1A1MAPTTHRB | |
| SCHEMBL3070925 | 0.65 | — | — | |
| SCHEMBL12868371 | 0.63 | KDM4E (0.49) | KDM4EALDH1A1MAPTTHRB | |
| SCHEMBL15120379 | 0.63 | CES2 (0.56) | KDM4EALDH1A1MAPTTHRB | |
| SCHEMBL10534862 | 0.62 | — | — | |
| SCHEMBL8800419 | 0.62 | FBP1 (0.36) | KDM4EALDH1A1MAPTTHRB | |
| SCHEMBL11298330 | 0.61 | CA2 (0.46) | ALDH1A1 | |
| SCHEMBL8800945 | 0.60 | L3MBTL1 (0.42) | ALDH1A1 | |
| SCHEMBL7566894 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2081955-A1 | METASTIN DERIVATIVES AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2009-07-29 | — | — | EP | disclosed |
| WO-2008050897-A1 | METASTIN DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-05-02 | — | — | WO | disclosed |