Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.61 |
| ▸ | VNN1 | O95497 | 13/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL7524751 | 0.98 | PTGS1 (0.63) | PTGS1KCNH2VNN1TSHRCA12 | |
| SCHEMBL10932748 | 0.98 | PTGS1 (0.63) | PTGS1KCNH2VNN1TSHRCA12 | |
| SCHEMBL7524756 | 0.98 | PTGS1 (0.63) | PTGS1KCNH2VNN1TSHRCA12 | |
| SCHEMBL11750108 | 0.97 | PTGS1 (0.61) | PTGS1KCNH2VNN1TSHRCA12 | |
| Water SCHEMBL29206580 | 0.97 | PTGS1 (0.61) | PTGS1KCNH2VNN1TSHRCA12 | |
| SCHEMBL10774486 | 0.90 | PTGS1 (0.61) | PTGS1KCNH2VNN1 | |
| SCHEMBL7016637 | 0.89 | PTGS1 (0.63) | PTGS1KCNH2VNN1 | |
| SCHEMBL2458620 | 0.87 | PTGS1 (0.61) | PTGS1KCNH2VNN1 | |
| SCHEMBL27597358 | 0.87 | PTGS1 (0.61) | PTGS1KCNH2VNN1 | |
| SCHEMBL888201 | 0.87 | PTGS1 (0.61) | PTGS1KCNH2VNN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109280015-A | A kind of synthesis of D-VB5 sodium and chiral separation method | 无锡凯夫制药有限公司 | 2019-01-29 | — | — | CN | disclosed |