Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.49 |
| ▸ | MMP3 | P08254 | 1/20 | 0.46 |
| ▸ | GCGR | P47871 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | EGLN2 | Q96KS0 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19579048 | 0.91 | KIF11 (0.52) | KIF11PTGS1MMP3GCGRMAPK14 | |
| SCHEMBL19917526 | 0.88 | KIF11 (0.46) | KIF11PTGS1MMP3GCGRMAPK14 | |
| SCHEMBL19579265 | 0.84 | KIF11 (0.50) | KIF11PTGS1MMP3GCGRMAPK14 | |
| SCHEMBL6721732 | 0.83 | CA12 (0.70) | PTGS1CA12CA2CA9PTGS2 | |
| SCHEMBL19917524 | 0.82 | TRPV4 (0.46) | KIF11PTGS1MMP3GCGRMAPK14 | |
| SCHEMBL18375385 | 0.81 | MMP3 (0.50) | KIF11PTGS1MMP3CYP11B2CA12 | |
| SCHEMBL27806612 | 0.81 | KIF11 (0.51) | KIF11PTGS1MMP3GCGRMAPK14 | |
| SCHEMBL397141 | 0.81 | KIF11 (0.61) | KIF11PTGS1MMP3GCGRMAPK14 | |
| SCHEMBL19579051 | 0.79 | PTGS1 (0.50) | KIF11PTGS1MMP3GCGRMAPK14 | |
| SCHEMBL19579102 | 0.78 | PTGS1 (0.50) | KIF11PTGS1MMP3GCGRMAPK14 |
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-3452471-B1 | ORGANIC MOLECULES, ESPECIALLY FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2021-12-08 | — | — | EP | disclosed |
| WO-2017190885-A1 | ORGANIC MOLECULES, ESPECIALLY FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2017-11-09 | — | — | WO | disclosed |