Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | SQOR | Q9Y6N5 | 2/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | METAP2 | P50579 | 2/20 | 0.31 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.30 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.30 |
| ▸ | TSPO | P30536 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23912068 | 0.94 | ALDH1A1 (0.37) | ALDH1A1HTTHSD17B10SQORPTGS1 | |
| SCHEMBL23912069 | 0.94 | ALDH1A1 (0.37) | ALDH1A1HTTHSD17B10SQORPTGS1 | |
| SCHEMBL20619468 | 0.91 | PTGS1 (0.32) | ALDH1A1HTTHSD17B10CYP11B2PTGS1 | |
| SCHEMBL23912045 | 0.90 | ADORA2A (0.36) | ALDH1A1HTTHSD17B10CYP11B2SQOR | |
| SCHEMBL23912050 | 0.90 | ADORA2A (0.36) | ALDH1A1HTTHSD17B10CYP11B2SQOR | |
| SCHEMBL23912034 | 0.89 | ALDH1A1 (0.35) | ALDH1A1HTTHSD17B10CYP11B2SQOR | |
| SCHEMBL23912035 | 0.89 | ALDH1A1 (0.35) | ALDH1A1HTTHSD17B10CYP11B2SQOR | |
| SCHEMBL23912051 | 0.89 | SQOR (0.38) | ALDH1A1HTTHSD17B10CYP11B2SQOR | |
| SCHEMBL23912095 | 0.88 | ALDH1A1 (0.34) | ALDH1A1HTTHSD17B10CYP11B2METAP2 | |
| SCHEMBL20619476 | 0.88 | PTGS1 (0.38) | ALDH1A1HTTHSD17B10CYP11B2PTGS1 |
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-3645522-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2021-10-13 | — | — | EP | disclosed |