Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | KHK | P50053 | 6/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.31 |
| ▸ | CDK9 | P50750 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL16365613 | 1.00 | HTR6 (0.46) | HTR6KHKCHRM2CHRM1CHRM3 | |
| SCHEMBL16365472 | 1.00 | HTR6 (0.46) | HTR6KHKCHRM2CHRM1CHRM3 | |
| SCHEMBL31208709 | 0.89 | HTR6 (0.39) | HTR6KHKCCNT1CDK9 | |
| SCHEMBL233141 | 0.88 | CHRM2 (0.37) | HTR6KHKCHRM2CHRM1CHRM3 | |
| Hydrochloric Acid SCHEMBL18693791 | 0.86 | CHRM2 (0.36) | HTR6KHKCHRM2CHRM1CHRM3 | |
| SCHEMBL21570134 | 0.86 | HTR6 (0.36) | HTR6KHKCCNT1CDK9 | |
| Hydrochloric Acid SCHEMBL2476511 | 0.84 | HTR6 (0.35) | HTR6CCNT1CDK9 | |
| SCHEMBL31209187 | 0.82 | HTR6 (0.38) | HTR6KHK | |
| SCHEMBL5225386 | 0.78 | HTR6 (0.50) | HTR6KHK | |
| SCHEMBL21816613 | 0.77 | IRAK4 (0.36) | CHRM2CHRM1CHRM3 |
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-2021129820-A1 | SPIRO RING-CONTAINING QUINAZOLINE COMPOUND | 微境生物医药科技(上海)有限公司 | 2021-07-01 | — | — | WO | disclosed |