Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DUT | P33316 | 2/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19973167 | 0.74 | KEAP1 (0.50) | DUT | |
| SCHEMBL3458584 | 0.74 | CYP11B1 (0.35) | DUT | |
| SCHEMBL19950913 | 0.73 | SCN10A (0.33) | PIK3CAMTOR | |
| SCHEMBL408605 | 0.73 | TAAR1 (0.40) | DUT | |
| SCHEMBL31132717 | 0.71 | PIK3CA (0.39) | PIK3CAMTOR | |
| SCHEMBL19950877 | 0.70 | SCN10A (0.30) | — | |
| SCHEMBL9701756 | 0.70 | DUT (0.36) | DUT | |
| SCHEMBL5871377 | 0.70 | MEN1 (0.42) | DUT | |
| SCHEMBL17428939 | 0.69 | KMT2A (0.41) | DUT | |
| SCHEMBL12002859 | 0.69 | DUT (0.40) | DUT |
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-3512833-A1 | HETEROARYL CARBOXAMIDE COMPOUNDS AS INHIBITORS OF RIPK2 | Boehringer Ingelheim International GmbH (DE) | 2019-07-24 | — | — | EP | disclosed |
| WO-2018052772-A1 | HETEROARYL CARBOXAMIDE COMPOUNDS AS INHIBITORS OF RIPK2 | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2018-03-22 | — | — | WO | disclosed |