Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC8 | Q09428 | 1/20 | 0.43 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6662120 | 0.84 | HTT (0.40) | ABCC8KCNJ11CA1CA2CA7 | |
| SCHEMBL15301641 | 0.78 | ALDH1A1 (0.43) | CA1CA2CA7CA13KMT2A | |
| SCHEMBL304909 | 0.78 | CA1 (0.49) | CA1CA2CA7CA13KMT2A | |
| SCHEMBL1512032 | 0.77 | KMT2A (0.55) | ABCC8KCNJ11KMT2AOPRK1PKM | |
| SCHEMBL6659419 | 0.76 | YTHDC1 (0.47) | ABCC8KCNJ11CA1CA2CA7 | |
| SCHEMBL1324570 | 0.75 | EGFR (0.51) | CA1CA2CA7CA13KMT2A | |
| SCHEMBL1839553 | 0.73 | ALDH1A1 (0.44) | ABCC8KCNJ11KMT2AOPRK1PKM | |
| SCHEMBL4927860 | 0.73 | CA1 (0.69) | CA1CA2CA7CA13MAPT | |
| SCHEMBL14123478 | 0.72 | ADORA2A (0.48) | KMT2APKMKDM4EMAPTLMNA | |
| SCHEMBL5244451 | 0.71 | MAPT (0.58) | KMT2AMAPTLMNAMEN1HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1444982-A1 | The use of purine derivatives as selective kinase inhibitors | MERCKLE GMBH (DE) | 2004-08-11 | — | — | EP | disclosed |