Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.33 |
| ▸ | GGPS1 | O95749 | 6/20 | 0.32 |
| ▸ | FDPS | P14324 | 8/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL20892679 | 0.98 | MEN1 (0.36) | MEN1MAPTKMT2AATML3MBTL1 | |
| SCHEMBL20892694 | 0.89 | ALDH1A1 (0.34) | MEN1MAPTKMT2AATML3MBTL1 | |
| SCHEMBL20892748 | 0.89 | MEN1 (0.35) | MEN1MAPTKMT2AATML3MBTL1 | |
| SCHEMBL20892703 | 0.81 | ALDH1A1 (0.36) | MEN1MAPTKMT2AATML3MBTL1 | |
| SCHEMBL22264697 | 0.79 | ALDH1A1 (0.40) | MEN1MAPTKMT2AATML3MBTL1 | |
| SCHEMBL22264644 | 0.79 | ALDH1A1 (0.40) | MEN1MAPTKMT2AATML3MBTL1 | |
| SCHEMBL20892747 | 0.78 | ALDH1A1 (0.36) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL47721 | 0.76 | ALDH1A1 (0.43) | CA12CA1CA2CA9CYP4F2 | |
| SCHEMBL28926125 | 0.72 | CA12 (0.50) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL28926138 | 0.69 | CA12 (0.42) | ATML3MBTL1CA12CA1CA2 |
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-20210332206-A1 | REGIOSELECTIVE C-H XANTHYLATION AS A PLATFORM TECHNOLOGY FOR POLYMER FUNCTIONALIZATION | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL | 2021-10-28 | — | — | US | disclosed |