Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 2/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL19617838 | 0.85 | SIGMAR1 (0.30) | KDRSIGMAR1 | |
| SCHEMBL19617745 | 0.78 | — | — | |
| SCHEMBL4984720 | 0.75 | TSHR (0.33) | KDRKCNH2 | |
| SCHEMBL19617841 | 0.74 | SMARCA4 (0.33) | KDRKCNH2 | |
| SCHEMBL21036409 | 0.74 | CD44 (0.30) | KDR | |
| Trifluoroacetic Acid SCHEMBL21003170 | 0.71 | KDR (0.33) | KDRKCNH2 | |
| SCHEMBL21319813 | 0.68 | DRD2 (0.45) | — | |
| SCHEMBL29428699 | 0.65 | KDM4E (0.33) | KDRKCNH2 | |
| SCHEMBL17298716 | 0.65 | KDM4E (0.33) | KDRKCNH2 | |
| SCHEMBL23174573 | 0.65 | MKNK2 (0.33) | KCNH2 |
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-3458445-A1 | KRAS G12C INHIBITORS | Mirati Therapeutics, Inc. (US) | 2019-03-27 | — | — | EP | disclosed |
| WO-2017201161-A1 | KRAS G12C INHIBITORS | Mirati Therapeutics, Inc. (US) | 2017-11-23 | — | — | WO | disclosed |