Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.44 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 9/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | THPO | P40225 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12059248 | 0.82 | PDK2 (0.42) | PDK2CXCR4HTR1ASLC6A2SLC6A4 | |
| SCHEMBL21942819 | 0.82 | ALDH1A1 (0.52) | PDK2CXCR4HTR1ASLC6A2SLC6A4 | |
| SCHEMBL17778193 | 0.82 | PDK2 (0.42) | PDK2CXCR4HTR1ASLC6A2SLC6A4 | |
| SCHEMBL29586612 | 0.82 | PDK2 (0.42) | PDK2CXCR4HTR1ASLC6A2SLC6A4 | |
| SCHEMBL30852252 | 0.82 | ALDH1A1 (0.52) | PDK2CXCR4HTR1ASLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL4799073 | 0.81 | PDK2 (0.41) | PDK2CXCR4HTR1ASLC6A2SLC6A4 | |
| SCHEMBL15677609 | 0.79 | PDK2 (0.41) | PDK2CXCR4HTR1ASLC6A2SLC6A4 | |
| SCHEMBL24485234 | 0.78 | HTR1A (0.40) | PDK2HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL13310539 | 0.78 | SSTR4 (0.40) | PDK2CXCR4HTR1ASLC6A2SLC6A4 | |
| SCHEMBL27936549 | 0.78 | PDK2 (0.43) | PDK2CXCR4HTR1ASLC6A2SLC6A4 |
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-4587014-A2 | C5AR1 ANTAGONISTS AND USES THEREOF | Vanqua Bio, Inc. (US) | 2025-07-23 | — | — | EP | disclosed |
| WO-2024059096-A2 | C5AR1 ANTAGONISTS AND USES THEREOF | VANQUA BIO, INC. (US) | 2024-03-21 | — | — | WO | disclosed |