Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.55 |
| ▸ | CA1 | P00915 | 4/20 | 0.55 |
| ▸ | CA2 | P00918 | 4/20 | 0.55 |
| ▸ | CA5A | P35218 | 4/20 | 0.55 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.55 |
| ▸ | CA12 | O43570 | 2/20 | 0.55 |
| ▸ | CA9 | Q16790 | 2/20 | 0.55 |
| ▸ | BCHE | P06276 | 1/20 | 0.54 |
| ▸ | OGT | O15294 | 2/20 | 0.52 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.50 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.50 |
| ▸ | CDC7 | O00311 | 1/20 | 0.50 |
| ▸ | FLT3 | P36888 | 2/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL17002291 | 1.00 | PTGS2 (0.55) | PTGS2CA1CA2CA5ACA5B | |
| SCHEMBL17002292 | 1.00 | PTGS2 (0.55) | PTGS2CA1CA2CA5ACA5B | |
| SCHEMBL17002364 | 0.97 | CA2 (0.58) | PTGS2CA1CA2CA5ACA5B | |
| SCHEMBL17002334 | 0.92 | HSD17B1 (0.57) | PTGS2CA1CA2CA5ACA5B | |
| SCHEMBL17002330 | 0.92 | BCHE (0.56) | PTGS2CA1CA2CA5ACA5B | |
| SCHEMBL17002429 | 0.92 | CA1 (0.50) | PTGS2CA1CA2CA5ACA5B | |
| SCHEMBL17002358 | 0.92 | CA1 (0.48) | PTGS2CA1CA2CA5ACA5B | |
| SCHEMBL17002424 | 0.92 | CA1 (0.48) | PTGS2CA1CA2CA5ACA5B | |
| SCHEMBL17002408 | 0.90 | BCHE (0.58) | PTGS2CA1CA2CA5ACA5B | |
| SCHEMBL17002418 | 0.90 | PTGS2 (0.47) | PTGS2CA1CA2CA5ACA5B |
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-2015118035-A1 | ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC COMPONENTS | CYNORA GMBH (DE) | 2015-08-13 | — | — | WO | disclosed |