Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD1 | P21728 | 1/20 | 0.64 |
| ▸ | PTGS1 | P23219 | 8/20 | 0.61 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.61 |
| ▸ | CA2 | P00918 | 6/20 | 0.53 |
| ▸ | CA9 | Q16790 | 6/20 | 0.53 |
| ▸ | CA12 | O43570 | 5/20 | 0.53 |
| ▸ | CA1 | P00915 | 4/20 | 0.53 |
| ▸ | RORC | P51449 | 3/20 | 0.50 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.48 |
| ▸ | KIF11 | P52732 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1081823 | 0.87 | PTGS1 (0.53) | DRD1PTGS1PTGS2CA2CA9 | |
| SCHEMBL1081818 | 0.83 | RORC (0.49) | DRD1PTGS1PTGS2CA2CA9 | |
| SCHEMBL1069088 | 0.82 | CA12 (0.49) | DRD1PTGS1PTGS2CA2CA9 | |
| SCHEMBL3879534 | 0.79 | PTGS2 (0.67) | DRD1PTGS1PTGS2CA2CA9 | |
| SCHEMBL14744155 | 0.78 | NCOA1 (0.51) | FFAR4 | |
| SCHEMBL29788132 | 0.77 | FFAR4 (0.55) | FFAR4 | |
| SCHEMBL306822 | 0.77 | FFAR4 (0.55) | FFAR4 | |
| SCHEMBL1045874 | 0.76 | FFAR4 (0.51) | RORCFFAR4 | |
| SCHEMBL5698536 | 0.76 | PTGS2 (1.00) | DRD1PTGS1PTGS2CA2CA9 | |
| SCHEMBL6725682 | 0.76 | KIF11 (0.77) | DRD1PTGS1PTGS2CA2CA9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2451285-A1 | PLATELET-ACTIVATING FACTOR RECEPTOR ANTAGONISTS | Merck Sharp & Dohme Corp. (US) | 2012-05-16 | — | — | EP | claimed |
| WO-2011005608-A1 | PLATELET-ACTIVATING FACTOR RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2011-01-13 | — | — | WO | claimed |
| EP-2451285-A1 | PLATELET-ACTIVATING FACTOR RECEPTOR ANTAGONISTS | Merck Sharp & Dohme Corp. (US) | 2012-05-16 | — | — | EP | disclosed |
| WO-2011005608-A1 | PLATELET-ACTIVATING FACTOR RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2011-01-13 | — | — | WO | disclosed |