Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 7/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD1 | P21728 | 2/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL19979180 | 1.00 | PNMT (0.46) | PNMTADRA2AADRA2BADRA2CCHRNB2 | |
| SCHEMBL24316298 | 0.93 | PNMT (0.50) | PNMTADRA2AADRA2BADRA2CCHRNB2 | |
| SCHEMBL13348988 | 0.80 | CHRNB2 (0.56) | PNMTADRA2AADRA2BADRA2CCHRNB2 | |
| SCHEMBL15479699 | 0.77 | PNMT (0.50) | PNMTADRA2AADRA2BADRA2CCHRNB2 | |
| SCHEMBL1690519 | 0.74 | PNMT (0.58) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL13291916 | 0.74 | SIGMAR1 (0.46) | CHRNB2CHRNA4SIGMAR1CYP19A1CYP11B1 | |
| SCHEMBL31159189 | 0.74 | PNMT (0.58) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL14348196 | 0.74 | SIGMAR1 (0.46) | CHRNB2CHRNA4SIGMAR1CYP19A1CYP11B1 | |
| SCHEMBL1690518 | 0.74 | PNMT (0.58) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL14490656 | 0.74 | SIGMAR1 (0.46) | CHRNB2CHRNA4SIGMAR1CYP19A1CYP11B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024063576-A1 | NOVEL QUINAZOLINE COMPOUND AS KRAS INHIBITOR | 일동제약(주) | 2024-03-28 | — | — | WO | disclosed |