Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | GNAI3 | P08754 | 8/20 | 0.36 |
| ▸ | GNAO1 | P09471 | 8/20 | 0.36 |
| ▸ | GNAI1 | P63096 | 8/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | HRH2 | P25021 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27613286 | 0.98 | BCHE (0.43) | BCHEGNAI3GNAO1GNAI1POLB | |
| SCHEMBL26522941 | 0.98 | BCHE (0.43) | BCHEGNAI3GNAO1GNAI1POLB | |
| SCHEMBL1072560 | 0.95 | NR1I2 (0.36) | BCHEGNAI3GNAO1GNAI1POLB | |
| SCHEMBL27663007 | 0.82 | GNAO1 (0.35) | GNAI3GNAO1GNAI1HRH2HRH1 | |
| SCHEMBL14437894 | 0.82 | SMN1; SMN2 (0.38) | SMN1; SMN2 | |
| SCHEMBL30306891 | 0.79 | GNAI3 (0.50) | BCHEGNAI3GNAO1GNAI1 | |
| SCHEMBL293862 | 0.77 | GNAO1 (0.39) | GNAI3GNAO1GNAI1HRH2HRH1 | |
| SCHEMBL8958766 | 0.76 | BCHE (0.54) | BCHEPOLBSMN1; SMN2S1PR4S1PR1 | |
| SCHEMBL1825154 | 0.76 | BCHE (0.54) | BCHEPOLBSMN1; SMN2S1PR4S1PR1 | |
| SCHEMBL28231353 | 0.76 | KDM4E (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109843856-A | KRAS G12C inhibitor | 米拉蒂治疗股份有限公司 | 2019-06-04 | — | — | CN | disclosed |