Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 1/20 | 0.44 |
| ▸ | TLR2 | O60603 | 1/20 | 0.44 |
| ▸ | HAO1 | Q9UJM8 | 9/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MELK | Q14680 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.34 |
| ▸ | ACACA | Q13085 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9367822 | 0.82 | TLR4 (0.47) | TLR4TLR2HAO1ALOX5P2RX3 | |
| SCHEMBL2354820 | 0.76 | TLR4 (0.49) | TLR4TLR2ALOX5P2RX3 | |
| SCHEMBL9050229 | 0.76 | TLR4 (0.42) | TLR4TLR2HAO1ALOX5ALDH1A1 | |
| SCHEMBL9386945 | 0.75 | ALOX5 (0.59) | HAO1ALOX5ALDH1A1 | |
| SCHEMBL8052741 | 0.74 | TLR4 (0.52) | TLR4TLR2ALDH1A1P2RX3 | |
| SCHEMBL28888769 | 0.74 | TLR4 (0.47) | TLR4TLR2ALOX5P2RX3 | |
| SCHEMBL9051135 | 0.72 | ALOX5 (0.39) | HAO1ALOX5EGFR | |
| SCHEMBL9045448 | 0.72 | ALOX5 (0.68) | ALOX5ACACBACACA | |
| SCHEMBL12100240 | 0.71 | TLR4 (0.52) | TLR4TLR2P2RX3ACACBACACA | |
| SCHEMBL8557561 | 0.71 | TLR4 (0.52) | TLR4TLR2ALDH1A1P2RX3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0540673-B1 | ACETYLENE DERIVATIVES HAVING LIPOXYGENASE INHIBITORY ACTIVITY | ABBOTT LAB (US) | 1996-10-16 | — | — | EP | disclosed |
| US-5559144-A | LIPOXYGENASE INHIBITORS, INHIBITORS OF BIOSYNTHESIS OF LEUKOTRIENES | ABBOTT LABORATORIES (US) | 1996-09-24 | — | — | US | disclosed |
| US-5476873-A | Inhibit biosynthesis of leukotrienes | ABBOTT LABORATORIES (US) | 1995-12-19 | — | — | US | disclosed |