Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 4/20 | 0.42 |
| ▸ | BRAF | P15056 | 3/20 | 0.42 |
| ▸ | AR | P10275 | 7/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL18070903 | 1.00 | KDR (0.42) | KDRBRAFARBLMTRPA1 | |
| SCHEMBL18048988 | 1.00 | KDR (0.42) | KDRBRAFARBLMTRPA1 | |
| SCHEMBL18070904 | 0.93 | LRRK2 (0.36) | KDRBRAFAR | |
| SCHEMBL18070905 | 0.93 | LRRK2 (0.36) | KDRBRAFAR | |
| SCHEMBL18048923 | 0.93 | LRRK2 (0.36) | KDRBRAFAR | |
| SCHEMBL18048935 | 0.88 | KDR (0.48) | KDRBRAFARBLM | |
| SCHEMBL18070949 | 0.88 | KDR (0.48) | KDRBRAFARBLM | |
| SCHEMBL18071012 | 0.88 | KDR (0.48) | KDRBRAFARBLM | |
| SCHEMBL18070987 | 0.82 | RET (0.41) | — | |
| SCHEMBL18070946 | 0.82 | RET (0.41) | — |
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-2016144797-A1 | ALPHA 7 NICOTINIC ACETYLCHOLINE RECEPTOR ALLOSTERIC MODULATORS, THEIR DERIVATIVES AND USES THEREOF | ALPHARMAGEN, LLC (US) | 2016-09-15 | — | — | WO | disclosed |