Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.32 |
| ▸ | CA12 | O43570 | 3/20 | 0.32 |
| ▸ | CA1 | P00915 | 3/20 | 0.32 |
| ▸ | CA7 | P43166 | 3/20 | 0.32 |
| ▸ | CA9 | Q16790 | 3/20 | 0.32 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | APAF1 | O14727 | 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 | |
|---|---|---|---|---|
| SCHEMBL7877692 | 1.00 | ALDH1A1 (0.32) | ALDH1A1CYP3A4KDM4EHSD17B10CA12 | |
| SCHEMBL7871684 | 0.68 | ALDH1A1 (0.48) | ALDH1A1KDM4EHSD17B10CA12CA1 | |
| SCHEMBL7871686 | 0.68 | ALDH1A1 (0.48) | ALDH1A1KDM4EHSD17B10CA12CA1 | |
| SCHEMBL7877695 | 0.67 | ALDH1A1 (0.37) | ALDH1A1KDM4EHSD17B10CA12CA1 | |
| SCHEMBL7873629 | 0.67 | ALDH1A1 (0.37) | ALDH1A1KDM4EHSD17B10CA12CA1 | |
| SCHEMBL7873630 | 0.67 | ALDH1A1 (0.37) | ALDH1A1KDM4EHSD17B10CA12CA1 | |
| SCHEMBL10506086 | 0.57 | ODC1 (0.42) | ALDH1A1KDM4ECA12CA1CA7 | |
| SCHEMBL10507292 | 0.56 | ODC1 (0.42) | ALDH1A1KDM4ECA12CA1CA7 | |
| SCHEMBL11122006 | 0.55 | NR1H4 (0.49) | ALDH1A1KDM4ECA12CA1CA7 | |
| SCHEMBL10507552 | 0.54 | ODC1 (0.43) | ALDH1A1KDM4ECA12CA1CA7 |
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-6313320-B1 | DESULFONATION, DEBLOCKING, DEPROTECTING; VIRICIDES | CHIROTECH TECHNOLOGY, INC. (GB) | 2001-11-06 | — | — | US | disclosed |