Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 5/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.47 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.47 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.47 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.47 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.47 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.47 |
| ▸ | TFEB | P19484 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1157682 | 0.83 | NFE2L2 (0.53) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL27751564 | 0.81 | NFE2L2 (0.52) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL7662974 | 0.80 | NFE2L2 (0.56) | NFE2L2TRPA1GRIN2DGRIN3BGRIN1 | |
| SCHEMBL7662971 | 0.80 | NFE2L2 (0.56) | NFE2L2TRPA1GRIN2DGRIN3BGRIN1 | |
| SCHEMBL8879885 | 0.79 | NFE2L2 (0.53) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL1759513 | 0.79 | NFE2L2 (0.53) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL6158467 | 0.78 | NFE2L2 (0.48) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL5609734 | 0.78 | NFE2L2 (0.48) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL28081748 | 0.77 | NFE2L2 (0.47) | NFE2L2TRPA1CA12CA1CA2 | |
| SCHEMBL8412532 | 0.76 | NFE2L2 (0.49) | NFE2L2TRPA1CA12CA1CA2 |
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-102812033-B | N6-substituted adenosine derivatives and N6-substituted adenine derivatives and uses thereof | INSTITUTE OF MATARIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) | 2015-11-25 | — | — | CN | disclosed |