Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KIF11 | P52732 | 5/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 2/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.39 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16698731 | 0.86 | CA4 (0.54) | TRPA1ALDH1A1TSHRKIF11KCNH2 | |
| SCHEMBL26862 | 0.86 | CA4 (0.54) | TRPA1ALDH1A1TSHRKIF11KCNH2 | |
| SCHEMBL121800 | 0.86 | CA4 (0.54) | TRPA1ALDH1A1TSHRKIF11KCNH2 | |
| Ammonia Solution, Strong SCHEMBL17187816 | 0.84 | CA4 (0.52) | TRPA1ALDH1A1TSHRKIF11KCNH2 | |
| SCHEMBL21551879 | 0.84 | CA4 (0.52) | TRPA1ALDH1A1TSHRKIF11KCNH2 | |
| Chlorotriphenylmethane SCHEMBL6250867 | 0.84 | ALDH1A1 (0.64) | ALDH1A1TSHRMAPTMAOBLMNA | |
| Styrene SCHEMBL11794937 | 0.82 | TRPA1 (0.69) | TRPA1ALDH1A1TSHRCA4LTA4H | |
| Styrene SCHEMBL28853750 | 0.80 | ALDH1A1 (0.64) | TRPA1ALDH1A1TSHRCA4LTA4H | |
| SCHEMBL16321127 | 0.80 | ACHE (0.56) | TRPA1ALDH1A1TSHRKIF11KCNH2 | |
| SCHEMBL12730666 | 0.80 | ACHE (0.56) | TRPA1ALDH1A1TSHRKIF11KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003051881-A1 | SUBSTITUTED PURINE NUCLEOSIDE LIBRARIES AND COMPOUNDS BY SOLID-PHASE COMBINATORIAL STRATEGIES | RIBAPHARM INC. (US) | 2003-06-26 | — | — | WO | disclosed |