Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 7/20 | 0.68 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 2/20 | 0.40 |
| ▸ | NOS1 | P29475 | 2/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL130264 | 0.87 | KIF11 (0.86) | KIF11CA2CA12EPHX2CA1 | |
| Hydrochloric Acid SCHEMBL27956160 | 0.85 | KIF11 (0.83) | KIF11CA2CA12EPHX2CA1 | |
| Hydrochloric Acid SCHEMBL27956162 | 0.85 | KIF11 (0.83) | KIF11CA2CA12EPHX2CA1 | |
| Iodide SCHEMBL29203651 | 0.85 | KIF11 (0.83) | KIF11CA2CA12EPHX2CA1 | |
| SCHEMBL3813225 | 0.82 | CA12 (0.63) | KIF11CA2CA12CA9ADRA2A | |
| SCHEMBL30102082 | 0.82 | HTR3E (0.56) | KIF11BRD4HTR3EHTR3BPLAU | |
| SCHEMBL17918860 | 0.82 | HTR3E (0.56) | KIF11BRD4HTR3EHTR3BPLAU | |
| SCHEMBL3813221 | 0.82 | CA12 (0.63) | KIF11CA2CA12CA9ADRA2A | |
| SCHEMBL5428301 | 0.81 | KIF11 (1.00) | KIF11CA2EPHX2CA1 | |
| SCHEMBL19272210 | 0.79 | ADRA2A (0.47) | KIF11BRD4ADRA2AADRA2BADRA2C |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10731078-B2 | Composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2020-08-04 | — | — | US | disclosed |
| US-20180030354-A1 | COMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2018-02-01 | — | — | US | disclosed |
| US-20180030354-A1 | COMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2018-02-01 | — | — | US | disclosed |