Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 2/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.33 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.31 |
| ▸ | CDK2 | P24941 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6204246 | 0.93 | BRAF (0.35) | BRAFCDK5CDK5R1ATMCCNE2 | |
| SCHEMBL6205471 | 0.86 | CDK5 (0.40) | BRAFCDK5CDK5R1ATMCCNE2 | |
| SCHEMBL6205187 | 0.86 | HTR2C (0.42) | CDK5CDK5R1ATMCCNE2CCNE1 | |
| SCHEMBL6202531 | 0.85 | CDK5 (0.46) | BRAFCDK5CDK5R1ATMCCNE2 | |
| SCHEMBL6204534 | 0.85 | CLK1 (0.36) | BRAFCDK5CDK5R1ATM | |
| SCHEMBL6204848 | 0.85 | CDK5 (0.40) | CDK5CDK5R1ATMCCNE2CCNE1 | |
| SCHEMBL6203534 | 0.82 | CCNE2 (0.46) | CCNE2CCNE1CDK2HTR2AHTR2C | |
| SCHEMBL6204529 | 0.82 | CCNE2 (0.44) | CDK5CDK5R1ATMCCNE2CCNE1 | |
| SCHEMBL6205216 | 0.82 | BRAF (0.36) | BRAFHTR2AHTR2C | |
| SCHEMBL6204524 | 0.80 | CCNE2 (0.34) | CDK5CDK5R1CCNE2CCNE1CDK2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1539760-A2 | AZAPURINE DERIVATIVES | INSTITUTE OF EXPERIMENTAL BOTANY ASCR (CZ) | 2005-06-15 | — | — | EP | claimed |
| WO-2004018473-A2 | AZAPURINE DERIVATIVES | INSTITUTE OF EXPERIMENTAL BOTANY ASCR (CZ) | 2004-03-04 | — | — | WO | claimed |
| EP-1539760-A2 | AZAPURINE DERIVATIVES | INSTITUTE OF EXPERIMENTAL BOTANY ASCR (CZ) | 2005-06-15 | — | — | EP | disclosed |
| WO-2004018473-A2 | AZAPURINE DERIVATIVES | INSTITUTE OF EXPERIMENTAL BOTANY ASCR (CZ) | 2004-03-04 | — | — | WO | disclosed |