Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 3/20 | 0.47 |
| ▸ | FFAR1 | O14842 | 4/20 | 0.46 |
| ▸ | PPARD | Q03181 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1549735 | 0.88 | HTT (0.47) | CA12CA1CA9PPARGALDH1A1 | |
| SCHEMBL4855183 | 0.87 | ESR1 (0.51) | CA12CA1CA9PPARGALDH1A1 | |
| SCHEMBL4199641 | 0.86 | ALDH1A1 (0.57) | FFAR1ALDH1A1POLBGAACYP2C19 | |
| SCHEMBL10814720 | 0.82 | HPGD (0.54) | PPARGFFAR1PPARDALDH1A1POLB | |
| SCHEMBL18467344 | 0.82 | ALDH1A1 (0.58) | CA12CA1CA9PPARGALDH1A1 | |
| SCHEMBL7447972 | 0.82 | ALDH1A1 (0.53) | ALDH1A1POLB | |
| SCHEMBL3616219 | 0.79 | MAPT (0.57) | PPARGALDH1A1PPARAPTGDR2 | |
| SCHEMBL6106511 | 0.79 | TDP1 (0.51) | PPARGFFAR1PPARDALDH1A1POLB | |
| SCHEMBL13197992 | 0.78 | CA12 (0.58) | CA12CA1CA9ALDH1A1POLB | |
| SCHEMBL2849293 | 0.78 | AAK1 (0.44) | CA12CA1CA9AAK1PTGDR2 |
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-0912175-A4 | FIBRINOGEN RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 1999-09-08 | — | — | EP | disclosed |
| EP-0912175-A1 | FIBRINOGEN RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 1999-05-06 | — | — | EP | disclosed |
| WO-1998000134-A1 | FIBRINOGEN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1998-01-08 | — | — | WO | disclosed |