Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 12/20 | 0.58 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.40 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.34 |
| ▸ | LY96 | Q9Y6Y9 | 3/20 | 0.34 |
| ▸ | SELP | P16109 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12601197 | 0.93 | TLR4 (0.66) | TLR4LPAR1SELP | |
| SCHEMBL10042148 | 0.93 | TLR4 (0.66) | TLR4LPAR1SELP | |
| SCHEMBL10070895 | 0.93 | TLR4 (0.66) | TLR4LPAR1SELP | |
| SCHEMBL12762975 | 0.93 | TLR4 (0.66) | TLR4LPAR1SELP | |
| SCHEMBL13803789 | 0.93 | TLR4 (0.66) | TLR4LPAR1SELP | |
| SCHEMBL10042131 | 0.91 | TLR4 (0.61) | TLR4LPAR1CNR1CNR2TRPV1 | |
| SCHEMBL14136616 | 0.89 | TLR4 (0.60) | TLR4 | |
| SCHEMBL12601198 | 0.86 | TLR4 (0.61) | TLR4LPAR1LY96 | |
| SCHEMBL12600779 | 0.86 | TLR4 (0.61) | TLR4LPAR1LY96 | |
| SCHEMBL10042150 | 0.86 | TLR4 (0.61) | TLR4LPAR1LY96 |
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 |
|---|---|---|---|---|---|---|---|
| US-7906633-B2 | Reagents and methods for preparing LPS antagonist B1287 and stereoisomers thereof | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2011-03-15 | — | — | US | disclosed |