Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | QPCT | Q16769 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.33 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | FDPS | P14324 | 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 | |
|---|---|---|---|---|
| SCHEMBL28348640 | 0.81 | HTT (0.35) | HTTALDH1A1NFKB1QPCTHSD17B10 | |
| SCHEMBL4097060 | 0.80 | NFKB1 (0.33) | HTTNFKB1QPCTHSD17B10QPCTL | |
| SCHEMBL10984244 | 0.79 | ALDH1A1 (0.36) | HTTALDH1A1NFKB1QPCTHSD17B10 | |
| SCHEMBL28133712 | 0.78 | CYP3A4 (0.35) | HTTALDH1A1NFKB1QPCTHSD17B10 | |
| SCHEMBL28102176 | 0.78 | ALDH1A1 (0.35) | HTTALDH1A1NFKB1QPCTHSD17B10 | |
| SCHEMBL27437475 | 0.77 | ALDH1A1 (0.32) | HTTALDH1A1NFKB1QPCTHSD17B10 | |
| SCHEMBL27752485 | 0.76 | ALDH1A1 (0.34) | ALDH1A1EGLN3FDPS | |
| SCHEMBL29118428 | 0.73 | ALDH1A1 (0.32) | ALDH1A1EGLN3 | |
| SCHEMBL28470760 | 0.73 | FDPS (0.33) | ALDH1A1EGLN3FDPS | |
| SCHEMBL27874750 | 0.72 | CYP3A4 (0.39) | HTTALDH1A1NFKB1QPCTHSD17B10 |
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-108123139-A | A kind of dedicated high temperature resistant binder of lithium battery and preparation method thereof | 成都新柯力化工科技有限公司 | 2018-06-05 | — | — | CN | disclosed |