Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 7/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PLK1 | P53350 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL20194449 | 0.88 | THRB (0.48) | THRBALDH1A1MAPTHPGDNPC1 | |
| SCHEMBL20194495 | 0.74 | EPHX2 (0.44) | ALDH1A1MAPTNPC1SMN1; SMN2POLB | |
| SCHEMBL6455411 | 0.73 | ALDH1A1 (0.57) | ALDH1A1MAPTHPGDPOLBLMNA | |
| SCHEMBL201331 | 0.72 | THRB (0.47) | THRB | |
| SCHEMBL201332 | 0.72 | THRB (0.47) | THRBNPC1SMN1; SMN2LMNA | |
| SCHEMBL20194516 | 0.69 | PTGER4 (0.43) | ALDH1A1MAPTHPGDLMNA | |
| SCHEMBL10688520 | 0.69 | MAOA (0.47) | THRBMAPTNPC1LMNARAB9A | |
| SCHEMBL12326346 | 0.67 | THRB (0.52) | THRBSMN1; SMN2 | |
| SCHEMBL12467693 | 0.67 | ALDH1A1 (0.52) | ALDH1A1MAPTPOLBLMNARAB9A | |
| SCHEMBL200878 | 0.66 | THRB (0.55) | THRBSMN1; SMN2PLK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3326715-A1 | OXALIC ACID MONOAMIDE LIGAND, AND USES THEREOF IN COUPLING REACTION OF COPPER-CATALYZED ARYL HALOGEN SUBSTITUTE | Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) | 2018-05-30 | — | — | EP | disclosed |