Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | RXRG | P48443 | 1/20 | 0.38 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | MAT2A | P31153 | 1/20 | 0.35 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | MYC | P01106 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.33 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22562482 | 0.97 | CTSS (0.36) | CTSSRXRARXRGALDH1A3PDK2 | |
| SCHEMBL22562440 | 0.92 | ALDH1A3 (0.41) | CTSSALDH1A3PDK2MAT2APTPN5 | |
| SCHEMBL22562518 | 0.92 | CTSS (0.38) | CTSSRXRARXRGALDH1A3PDK2 | |
| SCHEMBL22562484 | 0.92 | CTSS (0.36) | CTSSRXRARXRGALDH1A3PDK2 | |
| SCHEMBL22562259 | 0.91 | ALDH1A3 (0.42) | ALDH1A3PDK2GABRA1GABRG2GABRB3 | |
| SCHEMBL22562574 | 0.90 | CTSS (0.41) | CTSSALDH1A3PDK2MAT2AGABRA1 | |
| SCHEMBL22822207 | 0.89 | CTSS (0.44) | CTSSRXRARXRGALDH1A3PDK2 | |
| SCHEMBL22562479 | 0.89 | ALDH1A3 (0.37) | CTSSALDH1A3PDK2MAT2AGABRA1 | |
| SCHEMBL22562469 | 0.89 | RAB9A (0.38) | CTSSPDK2MAT2A | |
| SCHEMBL22562258 | 0.88 | ALDH1A3 (0.40) | ALDH1A3PDK2GABRA1GABRG2GABRB3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3418278-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2020-10-21 | — | — | EP | disclosed |