Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 9/20 | 0.53 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | RAC1 | P63000 | 1/20 | 0.48 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PRNP | P04156 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | NQO2 | P16083 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3393939 | 0.93 | CCR4 (0.53) | CCR4EGFRMAPTRAC1KCNH3 | |
| SCHEMBL3389001 | 0.86 | CCR4 (0.52) | CCR4MAPTRAC1KCNH3CYP2D6 | |
| SCHEMBL3392739 | 0.82 | CCR4 (0.54) | CCR4MAPTRAC1KCNH3CYP2D6 | |
| SCHEMBL3389918 | 0.78 | CCR4 (0.54) | CCR4EGFRMAPTRAC1KCNH3 | |
| SCHEMBL13868216 | 0.76 | RAC1 (0.81) | CCR4MAPTRAC1KCNH3CYP2D6 | |
| SCHEMBL29920803 | 0.76 | RAC1 (0.54) | CCR4MAPTRAC1KCNH3 | |
| SCHEMBL20966325 | 0.76 | RAC1 (0.54) | CCR4MAPTRAC1KCNH3 | |
| SCHEMBL879560 | 0.75 | EGFR (0.69) | EGFRMAPTSYK | |
| SCHEMBL3389537 | 0.71 | RAC1 (0.68) | CCR4MAPTRAC1KCNH3CYP2D6 | |
| SCHEMBL12185480 | 0.71 | EGFR (0.55) | EGFRPAK3PAK1PAK2SYK |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010119050-A1 | NEW RAC1 INHIBITORS AS POTENTIAL PHARMACOLOGICAL AGENTS FOR HEART FAILURE TREATMENT | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2010-10-21 | — | — | WO | claimed |
| EP-2241555-A1 | New RAC1 inhibitors as potential pharmacological agents for heart failure treatment | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2010-10-20 | — | — | EP | claimed |
| EP-2433636-A1 | Treatment of Malignant Diseases | Medizinische Universität Wien (AT) | 2012-03-28 | — | — | EP | disclosed |
| WO-2010119050-A1 | NEW RAC1 INHIBITORS AS POTENTIAL PHARMACOLOGICAL AGENTS FOR HEART FAILURE TREATMENT | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2010-10-21 | — | — | WO | disclosed |
| WO-2010119050-A1 | NEW RAC1 INHIBITORS AS POTENTIAL PHARMACOLOGICAL AGENTS FOR HEART FAILURE TREATMENT | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2010-10-21 | — | — | WO | disclosed |
| EP-2241555-A1 | New RAC1 inhibitors as potential pharmacological agents for heart failure treatment | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2010-10-20 | — | — | EP | disclosed |