Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.33 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 3/20 | 0.32 |
| ▸ | CA1 | P00915 | 3/20 | 0.32 |
| ▸ | CA2 | P00918 | 3/20 | 0.32 |
| ▸ | CA7 | P43166 | 3/20 | 0.32 |
| ▸ | CA9 | Q16790 | 3/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2784270 | 0.77 | TLR4 (0.45) | TLR4TSHRRAB9AABL1MAPT | |
| SCHEMBL19726325 | 0.73 | TLR4 (0.43) | TLR4ALDH1A1TSHRRAB9AABL1 | |
| SCHEMBL18059841 | 0.72 | TLR4 (0.44) | TLR4TSHRRAB9AABL1MAPT | |
| SCHEMBL8056133 | 0.72 | TLR4 (0.40) | TLR4ALDH1A1TSHRRAB9AABL1 | |
| SCHEMBL8056132 | 0.72 | TLR4 (0.40) | TLR4ALDH1A1TSHRRAB9AABL1 | |
| SCHEMBL8746923 | 0.71 | TLR4 (0.47) | TLR4ALDH1A1TSHRRAB9AMAPT | |
| SCHEMBL28369299 | 0.71 | MAPT (0.43) | TLR4ALDH1A1TSHRRAB9AMAPT | |
| SCHEMBL3273233 | 0.71 | ABCB11 (0.33) | ALDH1A1MAPK1LMNAGAA | |
| SCHEMBL18562240 | 0.70 | TLR4 (0.40) | TLR4ALDH1A1TSHRRAB9AABL1 | |
| SCHEMBL570733 | 0.69 | KCNH2 (0.37) | ALDH1A1TSHRATMLMNAGAA |
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-2016146689-A1 | ORGANOZINC REAGENTS AND PROCESSES FOR PREPARING AND USING THE SAME | LUDWIG-MAXIMILIANS-UNIVERSITÄT MÜNCHEN (DE) | 2016-09-22 | — | — | WO | disclosed |
| EP-3070083-A1 | Organozinc reagents and processes for preparing and using the same | Ludwig-Maximilians-Universität München (DE) | 2016-09-21 | — | — | EP | disclosed |