Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.34 |
| ▸ | CCND1 | P24385 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | GCGR | P47871 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Fluoromethane SCHEMBL27676699 | 0.99 | HTT (0.37) | HTTHSD17B10TRPV1CDK4CCND1 | |
| SCHEMBL31214453 | 0.86 | HSD17B10 (0.41) | HTTHSD17B10MAPTHSP90AA1HSP90B1 | |
| SCHEMBL6727082 | 0.77 | CA12 (0.50) | HTTHSD17B10MAPTHSP90AA1HSP90B1 | |
| SCHEMBL27693260 | 0.77 | HTT (0.43) | HTTHSD17B10MAPTARCA12 | |
| SCHEMBL6732295 | 0.77 | HTT (0.39) | HTTHSD17B10GSK3BMAPTHSP90AA1 | |
| SCHEMBL27675261 | 0.76 | HSD17B10 (0.35) | HTTHSD17B10TRPV1KDM4ELMNA | |
| SCHEMBL31214397 | 0.76 | HSD17B10 (0.42) | HTTHSD17B10MAPTCA12CA1 | |
| SCHEMBL1178516 | 0.76 | HSD17B10 (0.42) | HTTHSD17B10MAPTCA12CA1 | |
| SCHEMBL31214434 | 0.76 | HTT (0.42) | HTTHSD17B10MAPTCA12CA1 | |
| SCHEMBL1178609 | 0.76 | HSD17B10 (0.60) | HTTHSD17B10MAPTCA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-88100828-A | Substituted 2, 6-substituted pyridine compounds | — | 1988-08-24 | — | — | CN | disclosed |