Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 8/20 | 0.32 |
| ▸ | CES2 | O00748 | 3/20 | 0.31 |
| ▸ | CES1 | P23141 | 5/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12523450 | 0.83 | THRB (0.35) | LMNATHRBEPHX1FAAHCES2 | |
| SCHEMBL15114422 | 0.81 | LMNA (0.38) | LMNATHRBMMP8EPHX1MEN1 | |
| SCHEMBL14865917 | 0.80 | LMNA (0.33) | LMNAMMP8 | |
| SCHEMBL19266737 | 0.79 | HDAC4 (0.33) | LMNATHRBEPHX1FAAHCES2 | |
| SCHEMBL26329647 | 0.79 | CES2 (0.43) | EPHX1FAAHCES2CES1MEN1 | |
| SCHEMBL27559071 | 0.74 | LMNA (0.36) | LMNATHRB | |
| SCHEMBL9815203 | 0.74 | — | — | |
| SCHEMBL9815204 | 0.74 | TRPA1 (0.31) | ALDH1A1 | |
| SCHEMBL20848427 | 0.74 | ALDH1A1 (0.36) | LMNAMMP8KMT2AHSD17B10HDAC4 | |
| SCHEMBL23473944 | 0.73 | ALDH1A1 (0.39) | LMNAMMP8KMT2AHSD17B10HDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017100599-A1 | THIENOPYRIMIDINONE NMDA RECEPTOR MODULATORS AND USES THEREOF | LUC THERAPEUTICS (US) | 2017-06-15 | — | — | WO | disclosed |
| WO-2014121695-A1 | NOVEL XANTHINE OXIDASE INHIBITOR COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF | 镇江新元素医药科技有限公司 (CN) | 2014-08-14 | — | — | WO | disclosed |