Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR2 | O60603 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.37 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24379020 | 0.70 | CA1 (0.39) | TLR2ERN1TLR1TLR6ALDH1A1 | |
| SCHEMBL14198730 | 0.68 | CA1 (0.37) | TLR2ERN1TLR1TLR6ALDH1A1 | |
| SCHEMBL18090989 | 0.64 | CA1 (0.50) | TLR2ERN1TLR1TLR6ALDH1A1 | |
| SCHEMBL24204652 | 0.59 | CA1 (0.56) | TLR2ERN1TLR1TLR6ALDH1A1 | |
| SCHEMBL28118040 | 0.59 | ALDH1A1 (0.43) | TLR2ERN1TLR1TLR6ALDH1A1 | |
| SCHEMBL1402629 | 0.57 | CA1 (0.58) | TLR2ERN1TLR1TLR6ALDH1A1 | |
| Syringol SCHEMBL156388 | 0.57 | KDM4E (0.80) | TLR2ERN1TLR1TLR6ALDH1A1 | |
| SCHEMBL217560 | 0.57 | CA1 (0.58) | TLR2ERN1TLR1TLR6ALDH1A1 | |
| SCHEMBL358973 | 0.57 | ALDH1A1 (0.59) | ALDH1A1TP53CYP3A4KDM4ELMNA | |
| SCHEMBL6631636 | 0.56 | CA1 (0.50) | TLR2ERN1TLR1TLR6ALDH1A1 |
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-2007044933-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-04-19 | — | — | WO | disclosed |