Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR2 | O60603 | 3/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 7/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.41 |
| ▸ | S1PR2 | O95136 | 3/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.41 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.41 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 4/20 | 0.40 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10810237 | 0.95 | TLR2 (0.45) | TLR2S1PR1S1PR3S1PR2S1PR4 | |
| SCHEMBL10809425 | 0.94 | S1PR1 (0.42) | TLR2S1PR1S1PR3S1PR2S1PR4 | |
| SCHEMBL10806317 | 0.91 | S1PR1 (0.42) | TLR2S1PR1S1PR3S1PR2S1PR4 | |
| SCHEMBL10811961 | 0.90 | TLR2 (0.42) | TLR2S1PR1S1PR3S1PR2CNR2 | |
| SCHEMBL10806436 | 0.90 | TLR2 (0.42) | TLR2S1PR1S1PR3S1PR2CNR2 | |
| SCHEMBL10807540 | 0.89 | TLR2 (0.42) | TLR2S1PR1S1PR3S1PR2S1PR4 | |
| SCHEMBL10810610 | 0.88 | THRA (0.44) | TLR2PLA2G4ACNR2CNR1 | |
| SCHEMBL10802619 | 0.86 | S1PR1 (0.41) | TLR2S1PR1S1PR3S1PR2S1PR4 | |
| SCHEMBL10803956 | 0.85 | S1PR1 (0.43) | S1PR1S1PR3S1PR2S1PR4S1PR5 | |
| SCHEMBL10808995 | 0.85 | CYP2D6 (0.45) | CNR2CNR1 |
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-4640913-A | Phosphocholine derivatives having antihypertensive action | AMERICAN CYANAMID COMPANY (US) | 1987-02-03 | — | — | US | disclosed |