Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.53 |
| ▸ | CA1 | P00915 | 3/20 | 0.53 |
| ▸ | CA2 | P00918 | 3/20 | 0.53 |
| ▸ | CA9 | Q16790 | 3/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.51 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.50 |
| ▸ | GCGR | P47871 | 1/20 | 0.50 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.50 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.50 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.50 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.49 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.49 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 4/20 | 0.45 |
| ▸ | PPARA | Q07869 | 4/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | PPARD | Q03181 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL18805039 | 1.00 | CA12 (0.53) | CA12CA1CA2CA9HDAC8 | |
| SCHEMBL26750929 | 0.98 | CA12 (0.51) | CA12CA1CA2CA9HDAC8 | |
| SCHEMBL26750922 | 0.96 | CA12 (0.50) | CA12CA1CA2CA9HDAC8 | |
| SCHEMBL15306298 | 0.92 | ENPP1 (0.49) | CA12CA1CA2CA9HDAC8 | |
| SCHEMBL29892304 | 0.92 | CYP17A1 (0.49) | CA12CA1CA2CA9HDAC8 | |
| SCHEMBL24279337 | 0.89 | HDAC8 (0.47) | CA12CA1CA2CA9HDAC8 | |
| SCHEMBL26547936 | 0.89 | CA12 (0.51) | CA12CA1CA2CA9HDAC8 | |
| SCHEMBL26548380 | 0.89 | CA12 (0.51) | CA12CA1CA2CA9HDAC8 | |
| SCHEMBL3798335 | 0.89 | CA12 (0.62) | CA12CA1CA2CA9HDAC8 | |
| SCHEMBL16872441 | 0.88 | HPRT1 (0.52) | CA12CA1CA2CA9HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103289085-A | 2,6-naphthalic acid based heterocyclic polyaryletherketone and preparation method thereof | UNIV HUAQIAO | 2013-09-11 | — | — | CN | disclosed |
| US-6166072-A | Amino acid derivatives | ALLELIX NEUROSCIENCE, INC. (CA) | 2000-12-26 | — | — | US | disclosed |