Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QPCT | Q16769 | 2/20 | 0.71 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.71 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.71 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.71 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PRKCI | P41743 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hexane SCHEMBL27685940 | 1.00 | QPCT (0.71) | QPCTNFKB1HSD17B10QPCTLTBXAS1 | |
| Dodecane SCHEMBL27685941 | 0.98 | QPCT (0.68) | QPCTNFKB1HSD17B10QPCTLTBXAS1 | |
| Octane SCHEMBL28254399 | 0.98 | QPCT (0.68) | QPCTNFKB1HSD17B10QPCTLTBXAS1 | |
| Nonane SCHEMBL27922603 | 0.98 | QPCT (0.68) | QPCTNFKB1HSD17B10QPCTLTBXAS1 | |
| Decane SCHEMBL28356613 | 0.98 | QPCT (0.68) | QPCTNFKB1HSD17B10QPCTLTBXAS1 | |
| Hexane SCHEMBL27879545 | 0.98 | QPCT (0.68) | QPCTNFKB1HSD17B10QPCTLTBXAS1 | |
| Heptane SCHEMBL28253590 | 0.98 | QPCT (0.68) | QPCTNFKB1HSD17B10QPCTLTBXAS1 | |
| Octane SCHEMBL28389156 | 0.98 | QPCT (0.68) | QPCTNFKB1HSD17B10QPCTLTBXAS1 | |
| Heptane SCHEMBL28056960 | 0.98 | QPCT (0.68) | QPCTNFKB1HSD17B10QPCTLTBXAS1 | |
| Heptane SCHEMBL27473205 | 0.96 | QPCT (0.65) | QPCTNFKB1HSD17B10QPCTLTBXAS1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109046444-A | A kind of bifunctional catalyst and preparation method thereof of C8 aromatics isomerization | 中触媒新材料股份有限公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-108862314-A | One kind is with multi-stage porous and wide silica alumina ratio EUO structure molecular screen and synthetic method | 中触媒新材料股份有限公司 | 2018-11-23 | — | — | CN | disclosed |