Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL11328809 | 0.86 | ALDH1A1 (0.35) | ALDH1A1TDP1 | |
| SCHEMBL11328798 | 0.86 | ALDH1A1 (0.35) | ALDH1A1TDP1 | |
| SCHEMBL9358542 | 0.74 | ALDH1A1 (0.41) | ALDH1A1TDP1 | |
| SCHEMBL19035919 | 0.74 | ALDH1A1 (0.41) | ALDH1A1TDP1 | |
| SCHEMBL9358534 | 0.74 | ALDH1A1 (0.41) | ALDH1A1TDP1 | |
| SCHEMBL20146655 | 0.71 | ALDH1A1 (0.35) | ALDH1A1TDP1 | |
| SCHEMBL14959172 | 0.71 | ALDH1A1 (0.31) | ALDH1A1TDP1 | |
| SCHEMBL11352858 | 0.68 | ALDH1A1 (0.36) | ALDH1A1TDP1 | |
| SCHEMBL11352854 | 0.68 | ALDH1A1 (0.36) | ALDH1A1TDP1 | |
| SCHEMBL7617311 | 0.68 | — | — |
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-20190169210-A1 | Coordinative alignment of molecules in chiral metal-organic frameworks | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2019-06-06 | — | — | US | disclosed |