Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | CASP1 | P29466 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | SLC8B1 | Q6J4K2 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | PGR | P06401 | 2/20 | 0.45 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.44 |
| ▸ | CACNB4 | O00305 | 1/20 | 0.43 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.43 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.43 |
| ▸ | CACNG3 | O60359 | 1/20 | 0.43 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.43 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.43 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL23721282 | 0.87 | LMNA (0.42) | TSHRMAPTTP53CYP1A2CYP2C9 | |
| SCHEMBL13981271 | 0.85 | ATM (0.48) | TSHRMAPTTP53CYP1A2CYP2C9 | |
| SCHEMBL28355878 | 0.78 | MAPT (0.56) | TSHRMAPTTP53CYP1A2CYP2C9 | |
| SCHEMBL5435436 | 0.77 | MAPT (0.56) | TSHRMAPTTP53CYP1A2CYP2C9 | |
| SCHEMBL5177430 | 0.72 | MAPT (0.50) | TSHRMAPTTP53CYP1A2CYP2C9 | |
| SCHEMBL11027115 | 0.71 | CACNB4 (0.55) | TSHRMAPTTP53CYP1A2CYP2C9 | |
| SCHEMBL11080410 | 0.70 | MAPT (0.48) | TSHRMAPTTP53CYP1A2CYP2C9 | |
| SCHEMBL8117192 | 0.69 | MAPT (0.60) | TSHRMAPTTP53CYP1A2CYP2C9 | |
| SCHEMBL1623970 | 0.69 | ATM (0.46) | TSHRMAPTTP53CYP1A2CYP2C9 | |
| SCHEMBL4110833 | 0.69 | MAPT (0.55) | TSHRMAPTTP53CYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008145733-A2 | NOVEL CHEMICAL COMPOUNDS, PRODUCTION THEREOF, AND USE THEREOF | UNIVERSITÄT LEIPZIG (DE) | 2008-12-04 | — | — | WO | disclosed |