Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 5/20 | 0.62 |
| ▸ | TSHR | P16473 | 3/20 | 0.62 |
| ▸ | CD44 | P16070 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.39 |
| ▸ | G6PD | P11413 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29486565 | 0.89 | — | — | |
| SCHEMBL103071 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL30811553 | 0.87 | TRPA1 (0.54) | ALOX15TSHRCD44CYP3A4TDP1 | |
| O-Tolylamine SCHEMBL10386113 | 0.80 | CYP3A4 (0.68) | ALOX15TSHRCD44CYP3A4TDP1 | |
| Sulfuric Acid SCHEMBL15546534 | 0.79 | TRPA1 (0.46) | CD44TRPA1ATMALDH1A1CYP1A2 | |
| Questiomycin B SCHEMBL3999786 | 0.79 | ALOX15 (1.00) | ALOX15TSHRCYP3A4TDP1ALDH1A1 | |
| Questiomycin B SCHEMBL24436 | 0.79 | — | — | |
| Questiomycin B SCHEMBL29430322 | 0.79 | — | — | |
| Questiomycin B SCHEMBL11800423 | 0.79 | ALOX15 (0.56) | ALOX15TSHRCD44CYP3A4TDP1 | |
| SCHEMBL18612812 | 0.77 | ALOX15 (0.94) | ALOX15TSHRCYP3A4TDP1ALDH1A1 |
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-2008080067-A2 | CURATIVE SYSTEMS USEFUL IN STRUCTURAL FOAMS | HUNTSMAN ADVANCED MATERIALS AMERICAS INC. (US) | 2008-07-03 | — | — | WO | disclosed |