Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 1/20 | 0.59 |
| ▸ | APEX1 | P27695 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | CASP6 | P55212 | 1/20 | 0.50 |
| ▸ | THRA | P10827 | 3/20 | 0.48 |
| ▸ | THRB | P10828 | 5/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3530451 | 0.89 | VCAM1 (0.71) | VCAM1POLBHCAR3TSHRCASP6 | |
| SCHEMBL3866808 | 0.88 | APEX1 (0.66) | APEX1POLBHCAR3TSHRCASP6 | |
| SCHEMBL6450195 | 0.88 | VCAM1 (0.67) | VCAM1POLBTHRBMEN1KMT2A | |
| SCHEMBL7895159 | 0.82 | APEX1 (0.53) | APEX1POLBHCAR3TSHRCASP6 | |
| SCHEMBL18113472 | 0.78 | CASP6 (0.62) | VCAM1POLBHCAR3TSHRCASP6 | |
| SCHEMBL9185447 | 0.76 | CASP6 (0.64) | VCAM1APEX1POLBHCAR3TSHR | |
| SCHEMBL11680786 | 0.76 | CASP6 (0.64) | APEX1POLBHCAR3TSHRCASP6 | |
| SCHEMBL1025382 | 0.76 | APEX1 (0.69) | APEX1POLBHCAR3TSHRCASP6 | |
| SCHEMBL9499862 | 0.75 | POLB (0.59) | VCAM1POLBHCAR3TSHRCASP6 | |
| SCHEMBL6003204 | 0.75 | POLB (0.62) | VCAM1APEX1POLBHCAR3TSHR |
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-1565446-A1 | CHK-, PDK- AND AKT-INHIBITORY PYRIMIDINES, THEIR PRODUCTION AND USE AS PHARMACEUTICAL AGENTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2005-08-24 | — | — | EP | disclosed |
| WO-2004048343-A1 | CHK-, PDK- AND AKT-INHIBITORY PYRIMIDINES, THEIR PRODUCTION AND USE AS PHARMACEUTICAL AGENTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2004-06-10 | — | — | WO | disclosed |