Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | PDE9A | O76083 | 4/20 | 0.42 |
| ▸ | CCNK | O75909 | 1/20 | 0.42 |
| ▸ | CCND3 | P30281 | 1/20 | 0.42 |
| ▸ | CDK9 | P50750 | 1/20 | 0.42 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL5970283 | 0.82 | MEN1 (0.41) | L3MBTL1PDE9AALDH1A1POLBMEN1 | |
| SCHEMBL5970042 | 0.82 | ABL1 (0.43) | XDHALDH1A1TP53POLBMAPT | |
| SCHEMBL5970432 | 0.81 | ALDH1A1 (0.38) | XDHGAAALDH1A1POLBMAPT | |
| SCHEMBL5970233 | 0.77 | ALDH1A1 (0.45) | XDHALDH1A1CYP2D6 | |
| SCHEMBL932153 | 0.75 | XDH (0.60) | L3MBTL1XDHALDH1A1MEN1KMT2A | |
| SCHEMBL5970324 | 0.72 | ATM (0.47) | ATML3MBTL1PDE9AGAAALDH1A1 | |
| SCHEMBL5971083 | 0.72 | ATM (0.49) | ATML3MBTL1RXFP1PDE9ACCNK | |
| SCHEMBL1108641 | 0.70 | ATM (0.58) | ATML3MBTL1GAAALDH1A1TP53 | |
| SCHEMBL11562597 | 0.68 | VNN1 (0.58) | ATML3MBTL1MAPTMEN1KMT2A | |
| SCHEMBL158477 | 0.66 | ALDH1A1 (0.73) | XDHALDH1A1EGFRCYP1A2CYP2C19 |
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-1658291-A2 | SUBSTITUTED 8-HETEROARYL XANTHINES | Adenosine Therapeutics, LLC (US) | 2006-05-24 | — | — | EP | disclosed |
| WO-2005021548-A2 | SUBSTITUTED 8-HETEROARYL XANTHINES | ADENOSINE THERAPEUTICS, LLC (US) | 2005-03-10 | — | — | WO | disclosed |