Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY2 | P41231 | 1/20 | 0.44 |
| ▸ | GPR17 | Q13304 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | F9 | P00740 | 1/20 | 0.38 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.38 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.38 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.37 |
| ▸ | ATIC | P31939 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7568797 | 0.86 | P2RY2 (0.42) | P2RY2GPR17SMN1; SMN2POLBIDO1 | |
| SCHEMBL7637263 | 0.86 | P2RY2 (0.42) | P2RY2GPR17SMN1; SMN2POLBIDO1 | |
| SCHEMBL7562044 | 0.84 | SMN1; SMN2 (0.43) | P2RY2GPR17SMN1; SMN2POLBIDO1 | |
| SCHEMBL22095296 | 0.73 | ALDH1A1 (0.48) | SMN1; SMN2ALDH1A1GAAMEN1MAPT | |
| SCHEMBL22095297 | 0.73 | ALDH1A1 (0.48) | SMN1; SMN2ALDH1A1GAAMEN1MAPT | |
| SCHEMBL23928549 | 0.73 | MAPT (0.49) | SMN1; SMN2ALDH1A1GAAPDE4BMEN1 | |
| SCHEMBL7568763 | 0.71 | PDK1 (0.45) | SMN1; SMN2POLBALDH1A1KCNJ6KCNJ5 | |
| SCHEMBL7571560 | 0.71 | PDK1 (0.45) | SMN1; SMN2POLBALDH1A1KCNJ6KCNJ5 | |
| SCHEMBL17287764 | 0.70 | GPR17 (0.64) | P2RY2GPR17ALDH1A1GAAMEN1 | |
| SCHEMBL27602928 | 0.69 | BCHE (0.47) | P2RY2GPR17SMN1; SMN2IDO1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1222172-A1 | SYNTHESIS OF 1,3,5-TRISUBSTITUTED PYRAZOLES AND INTERMEDIATES THEREFORE | Bristol-Myers Squibb Pharma Company (US) | 2002-07-17 | — | — | EP | disclosed |
| WO-2001029006-A1 | SYNTHESIS OF 1,3,5-TRISUBSTITUTED PYRAZOLES AND INTERMEDIATES THEREFORE | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2001-04-26 | — | — | WO | disclosed |