Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 14/20 | 0.48 |
| ▸ | BRAF | P15056 | 10/20 | 0.48 |
| ▸ | RET | P07949 | 1/20 | 0.46 |
| ▸ | MAP3K7 | O43318 | 2/20 | 0.44 |
| ▸ | MAP4K2 | Q12851 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20568092 | 0.89 | RET (0.51) | KDRBRAFRETMAP3K7MAP4K2 | |
| SCHEMBL20570133 | 0.86 | BRAF (0.47) | KDRBRAFRETMAP3K7 | |
| SCHEMBL20570160 | 0.84 | MAP4K2 (0.63) | BRAFMAP3K7MAP4K2 | |
| SCHEMBL20568260 | 0.83 | MAP3K7 (0.53) | BRAFMAP3K7MAP4K2 | |
| SCHEMBL20569399 | 0.82 | MAP3K7 (0.51) | KDRBRAFRETMAP3K7MAP4K2 | |
| SCHEMBL20568087 | 0.82 | KDR (0.48) | KDRBRAFRETMAP3K7MAP4K2 | |
| SCHEMBL20568109 | 0.82 | RET (0.50) | KDRBRAFRETMAP3K7MAP4K2 | |
| SCHEMBL20568112 | 0.81 | KDR (0.54) | KDRBRAFRETMAP3K7MAP4K2 | |
| SCHEMBL20568417 | 0.81 | MAP3K7 (0.56) | KDRBRAFRETMAP3K7MAP4K2 | |
| SCHEMBL20567971 | 0.80 | MAP4K2 (0.62) | BRAFMAP3K7MAP4K2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112601752-A | Novel inhibitors of MAP4K1 | 伊克诺斯科学公司 | 2021-04-02 | — | — | CN | claimed |
| EP-3630778-A1 | NOVEL INHIBITORS OF MAP4K1 | Ichnos Sciences SA (CH) | 2020-04-08 | — | — | EP | claimed |
| WO-2018215668-A1 | NOVEL INHIBITORS OF MAP4K1 | GLENMARK PHARMACEUTICALS S.A. (CH) | 2018-11-29 | — | — | WO | claimed |