Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 11/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | LTA4H | P09960 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28770177 | 1.00 | KIF11 (0.54) | KIF11KCNH2CA4LTA4HCA12 | |
| SCHEMBL7043985 | 0.91 | CA1 (0.55) | KIF11KCNH2CA4CA12CA1 | |
| SCHEMBL113271 | 0.85 | KCNN4 (0.61) | KIF11KCNH2CA4LTA4HCA12 | |
| Triphenylmethanamine SCHEMBL14120500 | 0.85 | KCNN4 (0.61) | KIF11KCNH2CA4LTA4HCA12 | |
| SCHEMBL1271654 | 0.85 | KCNN4 (0.61) | KIF11KCNH2CA4LTA4HCA12 | |
| Hydrochloric Acid SCHEMBL20241920 | 0.83 | KCNN4 (0.58) | KIF11KCNH2CA4LTA4HCA12 | |
| SCHEMBL2689280 | 0.83 | CA4 (0.56) | KIF11KCNH2CA4LTA4HCA12 | |
| SCHEMBL4570566 | 0.83 | CA4 (0.56) | KIF11KCNH2CA4LTA4HCA12 | |
| SCHEMBL25048 | 0.83 | CA4 (0.56) | KIF11KCNH2CA4LTA4HCA12 | |
| SCHEMBL10194078 | 0.82 | ALDH1A1 (0.52) | KIF11KCNH2AOC3SMN1; SMN2MAPK1 |
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-110437230-B | Tertiary amine compound, diphosphine ligand, intermediate and preparation method thereof | 中国科学院上海有机化学研究所 | 2022-06-21 | — | — | CN | disclosed |
| EP-3133445-A1 | CHEMICALLY AMPLIFIED RESIST MATERIAL | OSAKA UNIVERSITY (JP) | 2017-02-22 | — | — | EP | disclosed |