Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 3/20 | 0.42 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.42 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.41 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | MAPT | P10636 | 7/20 | 0.40 |
| ▸ | HPGD | P15428 | 7/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 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 | |
|---|---|---|---|---|
| SCHEMBL5741054 | 0.94 | BACE1 (0.46) | BACE1EGFRERBB2AGPAT2KDM4E | |
| SCHEMBL5743131 | 0.94 | BACE1 (0.50) | BACE1AGPAT2KDM4EALDH1A1MAPT | |
| SCHEMBL5740722 | 0.91 | BACE1 (0.49) | BACE1AGPAT2KDM4EALDH1A1MAPT | |
| SCHEMBL5742899 | 0.89 | AGPAT2 (0.55) | BACE1AGPAT2KDM4EALDH1A1MAPT | |
| SCHEMBL5744147 | 0.88 | MCHR1 (0.47) | BACE1AGPAT2KDM4EALDH1A1MAPT | |
| SCHEMBL5742375 | 0.88 | MAPT (0.51) | BACE1AGPAT2KDM4EALDH1A1MAPT | |
| SCHEMBL5744066 | 0.88 | DOT1L (0.49) | BACE1AGPAT2ALDH1A1MAPT | |
| SCHEMBL5740131 | 0.87 | AGPAT2 (0.54) | AGPAT2MAPTHPGDHTTTHRB | |
| SCHEMBL5743044 | 0.87 | AGPAT2 (0.50) | AGPAT2MAPTTHRBLMNAABCG2 | |
| SCHEMBL5742913 | 0.87 | KMT2A (0.43) | EGFRERBB2AGPAT2KDM4EALDH1A1 |
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-1339706-B1 | N-TYPE CALCIUM CHANNEL ANTAGONISTS FOR THE TREATMENT OF PAIN | ASTRAZENECA AB (SE) | 2006-04-19 | — | — | EP | disclosed |