Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | NPR3 | P17342 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | PREP | P48147 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18171836 | 1.00 | CTSK (0.41) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL15341008 | 0.85 | PREP (0.40) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL23260554 | 0.82 | CTSK (0.57) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL11910515 | 0.82 | NPR3 (0.42) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL15312479 | 0.82 | CTSK (0.47) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL11603564 | 0.81 | CTSS (0.42) | CTSKCTSSCA2CA1CA7 | |
| Hydrochloric Acid SCHEMBL15312476 | 0.81 | CTSK (0.46) | CTSKCTSSCA2CA1CA7 | |
| Hydrochloric Acid SCHEMBL15312478 | 0.81 | CTSK (0.46) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL536280 | 0.81 | CTSK (0.47) | CTSKCTSSCA2CA1CA7 | |
| SCHEMBL536281 | 0.81 | CTSK (0.47) | CTSKCTSSCA2CA1CA7 |
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-2016169908-A1 | URACIL DERIVATIVES FOR THE TREATMENT OF MALARIA | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2016-10-27 | — | — | WO | disclosed |