Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5300723 | 1.00 | ALDH1A1 (0.32) | ALDH1A1TDP1TSHRMAPK1ATM | |
| SCHEMBL9879405 | 0.89 | CPA1 (0.31) | — | |
| SCHEMBL12083804 | 0.84 | — | — | |
| SCHEMBL1857428 | 0.80 | ALDH1A1 (0.32) | ALDH1A1TDP1TSHRMAPK1ATM | |
| SCHEMBL1702949 | 0.76 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL28454880 | 0.75 | TSHR (0.33) | ALDH1A1TDP1TSHR | |
| SCHEMBL9879411 | 0.73 | TDP1 (0.31) | ALDH1A1TDP1 | |
| SCHEMBL20641014 | 0.72 | — | — | |
| SCHEMBL6384594 | 0.72 | — | — | |
| SCHEMBL9052189 | 0.72 | — | — |
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-2007014544-A2 | STEREOSELECTIVE SYNTHESIS OF CHIRAL DIOLS | JULICH CHIRAL SOLUTIONS GMBH (DE) | 2007-02-08 | — | — | WO | disclosed |
| EP-1067195-B1 | Process for reducing keto-group containing compounds | FORSCHUNGSZENTRUM JUELICH GMBH (DE) | 2006-09-20 | — | — | EP | disclosed |
| EP-1067195-A2 | Process for reducing keto-group containing compounds | FORSCHUNGSZENTRUM JÜLICH GMBH (DE) | 2001-01-10 | — | — | EP | disclosed |