Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ANPEP | P15144 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15241647 | 0.82 | ROCK2 (0.45) | ALDH1A1KDM4EL3MBTL1ROCK2ROCK1 | |
| SCHEMBL12831003 | 0.75 | ROCK2 (0.48) | ALDH1A1KDM4EL3MBTL1ROCK2ROCK1 | |
| SCHEMBL12830442 | 0.74 | CYP2C19 (0.53) | ALDH1A1KDM4EEPHX2RAB9AEPHX1 | |
| SCHEMBL12830920 | 0.70 | TSHR (0.42) | ALDH1A1KDM4EL3MBTL1LMNAMAPK1 | |
| SCHEMBL353107 | 0.68 | ROCK1 (0.68) | ROCK2ROCK1EPHX2ATG4B | |
| SCHEMBL15258595 | 0.67 | CASP3 (0.53) | ROCK2ROCK1RAB9A | |
| SCHEMBL14434568 | 0.67 | LMNA (0.73) | L3MBTL1ROCK2NAMPTEPHX2LMNA | |
| SCHEMBL3509234 | 0.67 | ROCK1 (0.56) | ROCK2ROCK1NAMPTATG4B | |
| SCHEMBL353616 | 0.66 | ROCK2 (0.53) | ROCK2ROCK1NAMPTEPHX2ATG4B | |
| SCHEMBL10237503 | 0.66 | ROCK1 (0.61) | ROCK2ROCK1NAMPTATG4B |
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 |
|---|---|---|---|---|---|---|---|
| US-20140051711-A1 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | CALCIMEDICA INC. (US) | 2014-02-20 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20140051711-A1 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | ORAI1, SARAF, RYR2 | ALDH1A1 4409/4885KDM4E 4057/4885L3MBTL1 3943/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.