Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.33 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.31 |
| ▸ | KIF11 | P52732 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | FABP3 | P05413 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.30 |
| ▸ | HTR2A | P28223 | 2/20 | 0.30 |
| ▸ | HTR2C | P28335 | 2/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8601255 | 0.83 | KCNN4 (0.48) | TSHRKCNN4CYP1A2CYP2A6CYP3A4 | |
| SCHEMBL368875 | 0.83 | TSHR (0.41) | TSHRKCNN4CYP1A2CYP2A6CYP3A4 | |
| SCHEMBL6136339 | 0.82 | TSHR (0.39) | TSHRKCNN4CYP1A2CYP3A4KCNA3 | |
| SCHEMBL4114626 | 0.80 | TSHR (0.38) | TSHRKCNN4CYP1A2MAPK1CYP19A1 | |
| SCHEMBL6337202 | 0.76 | KCNN4 (0.59) | TSHRKCNN4CYP1A2CYP2A6CYP3A4 | |
| SCHEMBL11724522 | 0.74 | TSHR (0.55) | TSHRKCNN4CYP1A2CYP3A4MAPK1 | |
| SCHEMBL11861355 | 0.73 | KCNN4 (0.42) | TSHRKCNN4CYP1A2CYP2A6CYP3A4 | |
| SCHEMBL6203055 | 0.73 | TSHR (0.57) | TSHRKCNN4CYP1A2CYP2A6CYP3A4 | |
| SCHEMBL6415524 | 0.72 | TSHR (0.48) | TSHRCYP2A6CYP3A4MAPK1LMNA | |
| SCHEMBL151981 | 0.71 | TSHR (0.65) | TSHRKCNN4CYP1A2CYP3A4MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4141912-A | Process for the preparation of polyhalobenzylic disulfooxonium compounds | HOOKER CHEMICALS & PLASTICS CORP. (US) | 1979-02-27 | — | — | US | disclosed |
| US-4075238-A | Polyhalobenzylic disulfooxonium compounds | HOOKER CHEMICALS & PLASTICS CORPORATION (US) | 1978-02-21 | — | — | US | disclosed |