Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAL | P20701 | 6/20 | 0.41 |
| ▸ | ITGB2 | P05107 | 5/20 | 0.41 |
| ▸ | ICAM1 | P05362 | 5/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | P2RY12 | Q9H244 | 2/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | SMO | Q99835 | 2/20 | 0.38 |
| ▸ | CKS1B | P61024 | 1/20 | 0.38 |
| ▸ | SKP1 | P63208 | 1/20 | 0.38 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.37 |
| ▸ | AKT2 | P31751 | 1/20 | 0.37 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.37 |
| ▸ | WNT3A | P56704 | 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 | |
|---|---|---|---|---|
| SCHEMBL7514586 | 0.89 | ITGAL (0.52) | ITGALITGB2ICAM1NCF1CNR2 | |
| SCHEMBL7512812 | 0.87 | PTPN11 (0.43) | ITGALITGB2ICAM1NCF1CNR2 | |
| SCHEMBL7519270 | 0.85 | ALDH1A1 (0.42) | NCF1PIK3CAMTORMEN1KMT2A | |
| SCHEMBL7515130 | 0.84 | ITGAL (0.47) | ITGALITGB2ICAM1NCF1CNR2 | |
| SCHEMBL7518407 | 0.84 | ALK (0.39) | ITGALITGB2ICAM1 | |
| SCHEMBL7514841 | 0.82 | CLK1 (0.42) | ITGALITGB2ICAM1NCF1PIK3CD | |
| SCHEMBL7522989 | 0.81 | CNR2 (0.44) | NCF1MEN1KMT2AATMCNR2 | |
| SCHEMBL7519326 | 0.81 | ALDH1A1 (0.43) | ITGALITGB2ICAM1NCF1MEN1 | |
| SCHEMBL7516894 | 0.79 | RXFP1 (0.55) | ITGALNCF1CNR2SMOCKS1B | |
| SCHEMBL7519963 | 0.78 | CKS1B (0.46) | NCF1CNR2SMOCKS1BSKP1 |
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-1165522-A1 | NEUROTROPHIC THIO SUBSTITUTED PYRIMIDINES | Krenitsky Pharmaceuticals, Inc. (US) | 2002-01-02 | — | — | EP | claimed |
| WO-2000059893-A1 | NEUROTROPHIC THIO SUBSTITUTED PYRIMIDINES | KRENITSKY PHARMACEUTICALS INC. (US) | 2000-10-12 | — | — | WO | claimed |