Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.38 |
| ▸ | CYP2A13 | Q16696 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6557590 | 0.76 | HTT (0.47) | HTTCYP2C9ALOX15HSD17B10HRH3 | |
| SCHEMBL27669230 | 0.72 | KMT2A (0.49) | HTTHRH3HIF1AEPAS1MEN1 | |
| SCHEMBL7934201 | 0.72 | SMN1; SMN2 (0.64) | HTTHRH3HIF1AEPAS1ALDH1A1 | |
| SCHEMBL27527176 | 0.71 | MEN1 (0.39) | MEN1ALDH1A1KMT2A | |
| SCHEMBL13828361 | 0.70 | HTT (0.51) | HTTCYP2C9ALOX15HSD17B10HRH3 | |
| SCHEMBL21127874 | 0.70 | HTT (0.51) | HTTCYP2C9ALOX15HSD17B10HRH3 | |
| SCHEMBL14235300 | 0.70 | HTT (0.51) | HTTCYP2C9ALOX15HSD17B10HRH3 | |
| SCHEMBL27611661 | 0.70 | HRH3 (0.52) | HTTCYP2C9ALOX15HSD17B10HRH3 | |
| SCHEMBL1928227 | 0.70 | KDM4E (0.67) | HTTCYP2C9ALOX15HSD17B10HRH3 | |
| SCHEMBL3825358 | 0.69 | HRH3 (0.60) | HTTCYP2C9ALOX15HSD17B10HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1186328-C | Substd. 5-benzyl-2,4-diaminopyrimidines | BASLIDE PHARMA AG (CH) | 2005-01-26 | — | — | CN | disclosed |