Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16619786 | 0.82 | MAPT (0.35) | NPSR1 | |
| SCHEMBL16619720 | 0.78 | CTSB (0.37) | — | |
| SCHEMBL29584493 | 0.74 | CYP19A1 (0.32) | CYP19A1 | |
| SCHEMBL16620569 | 0.74 | CYP19A1 (0.32) | CYP19A1 | |
| SCHEMBL16620640 | 0.73 | KMT2A (0.40) | NPSR1 | |
| SCHEMBL16620027 | 0.73 | CTSB (0.33) | CYP19A1 | |
| SCHEMBL20916820 | 0.71 | CTSB (0.35) | CYP19A1NPSR1 | |
| SCHEMBL30554375 | 0.71 | CTSB (0.35) | CYP19A1NPSR1 | |
| SCHEMBL1201016 | 0.70 | PIN1 (0.32) | CYP19A1 | |
| SCHEMBL16620361 | 0.70 | MEN1 (0.36) | NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3052096-A1 | INHIBITORS OF ERK AND METHODS OF USE | Kura Oncology, Inc. (US) | 2016-08-10 | — | — | EP | disclosed |
| WO-2015051341-A1 | INHIBITORS OF ERK AND METHODS OF USE | ARAXES PHARMA LLC (US) | 2015-04-09 | — | — | WO | disclosed |