Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1G | O43497 | 3/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.67 |
| ▸ | GAA | P10253 | 3/20 | 0.66 |
| ▸ | MAPT | P10636 | 5/20 | 0.66 |
| ▸ | LMNA | P02545 | 4/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.66 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.66 |
| ▸ | IGF1R | P08069 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.55 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL11460456 | 0.89 | IGF1R (0.70) | CACNA1GKCNH2GAAMAPTLMNA | |
| SCHEMBL13875132 | 0.88 | IGF1R (0.65) | CACNA1GKCNH2GAAMAPTLMNA | |
| SCHEMBL4754252 | 0.87 | GAA (0.68) | CACNA1GKCNH2GAAMAPTLMNA | |
| SCHEMBL11465764 | 0.85 | IGF1R (0.65) | CACNA1GKCNH2GAAMAPTLMNA | |
| SCHEMBL2017996 | 0.83 | MAPT (0.74) | CACNA1GKCNH2GAAMAPTLMNA | |
| SCHEMBL2017993 | 0.83 | MAPT (0.74) | CACNA1GKCNH2GAAMAPTLMNA | |
| SCHEMBL2017995 | 0.83 | MAPT (0.74) | CACNA1GKCNH2GAAMAPTLMNA | |
| Hydrochloric Acid SCHEMBL8576435 | 0.83 | IGF1R (0.65) | CACNA1GKCNH2GAAMAPTLMNA | |
| SCHEMBL11453795 | 0.81 | IGF1R (0.67) | GAAMAPTLMNASMN1; SMN2HSD17B10 | |
| SCHEMBL9015935 | 0.81 | ALDH1A1 (0.74) | GAAMAPTLMNAPOLBALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7291624-B2 | CDK-inhibitory pyrimidines, their production and use as pharmaceutical agents | BAYER SCHERING PHARMA AG (DE) | 2007-11-06 | — | — | US | disclosed |
| US-7235561-B2 | Compound and a composition including such a compound | SCHERING AG (DE) | 2007-06-26 | — | — | US | disclosed |