Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 5/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 5/20 | 0.48 |
| ▸ | P2RX7 | Q99572 | 13/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.45 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20205261 | 0.78 | P2RX7 (0.45) | HTR1AADRA1AADRA1BP2RX7 | |
| SCHEMBL20103445 | 0.76 | P2RX7 (0.52) | P2RX7 | |
| SCHEMBL20103153 | 0.76 | P2RX7 (0.45) | HTR1AADRA1AADRA1BP2RX7 | |
| SCHEMBL2250478 | 0.72 | P2RX7 (0.51) | P2RX7 | |
| SCHEMBL22904441 | 0.71 | HTR1A (0.46) | HTR1AADRA1AADRA1BP2RX7ADRA1D | |
| SCHEMBL3654179 | 0.71 | P2RX7 (0.52) | P2RX7 | |
| SCHEMBL18208494 | 0.69 | P2RX7 (0.45) | P2RX7 | |
| SCHEMBL28224399 | 0.68 | ALDH1A1 (0.62) | P2RX7 | |
| SCHEMBL18208520 | 0.68 | P2RX7 (0.44) | P2RX7 | |
| SCHEMBL18208191 | 0.68 | P2RX7 (0.44) | P2RX7 |
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-2018078005-A1 | AMIDO-SUBSTITUTED AZASPIRO DERIVATIVES AS TANKYRASE INHIBITORS | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-03 | — | — | WO | disclosed |