Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 3/20 | 0.55 |
| ▸ | BCR | P11274 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.43 |
| ▸ | SLC34A1 | Q06495 | 4/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 5/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.41 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.41 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28017385 | 0.99 | ABL1 (0.54) | ABL1BCRCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL22838698 | 0.84 | SYK (0.42) | ABL1BCRCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29446490 | 0.81 | ABL1 (0.49) | ABL1BCRTRPA1KCNH2MAP4K4 | |
| SCHEMBL28074525 | 0.80 | CYP1A2 (0.52) | ABL1BCRCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL22838720 | 0.80 | CYP1A2 (0.46) | ABL1CYP1A2CYP3A4CYP2D6ALOX15 | |
| SCHEMBL16906526 | 0.80 | ABL1 (0.46) | ABL1BCRSLC34A1TRPA1KCNH2 | |
| SCHEMBL16894166 | 0.80 | ABL1 (0.61) | ABL1BCRCYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL28242155 | 0.79 | TRPV3 (0.43) | TRPA1KCNH2MAP4K4PIK3CAMINK1 | |
| SCHEMBL16903669 | 0.79 | ABL1 (0.45) | ABL1BCRTRPA1KCNH2MAP4K4 | |
| Hydrochloric Acid SCHEMBL16894261 | 0.79 | ABL1 (0.59) | ABL1BCRCYP1A2CYP3A4CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105612153-B | Substituted heterocyclic sulfonamide compound as TRPA1 conditioning agents | 豪夫迈·罗氏有限公司 | 2018-09-14 | — | — | CN | disclosed |
| CN-104684899-B | Substituted sulfonamide compounds | 霍夫曼-拉罗奇有限公司 | 2017-07-04 | — | — | CN | disclosed |
| CN-105612153-A | Substituted sulfonamide compounds as TRPA1 conditioner | HOFFMANN LA ROCHE | 2016-05-25 | — | — | CN | disclosed |
| CN-104684899-A | Substituted sulfonamide compounds | HOFFMANN LA ROCHE | 2015-06-03 | — | — | CN | disclosed |