Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP3 | P15309 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2649566 | 0.82 | ACP3 (0.47) | ACP3MEN1KMT2AADRA1DPARP1 | |
| SCHEMBL10939067 | 0.82 | MEN1 (0.53) | ACP3MEN1KMT2APARP1ALDH1A1 | |
| SCHEMBL22917154 | 0.82 | ACP3 (0.47) | ACP3MEN1KMT2AADRA1DPARP1 | |
| SCHEMBL7283486 | 0.81 | PARP1 (0.50) | ACP3MEN1KMT2AADRA1DPARP1 | |
| SCHEMBL6626050 | 0.81 | ACHE (0.46) | ACP3MEN1KMT2APARP1ALDH1A1 | |
| SCHEMBL12907075 | 0.81 | ACP3 (0.46) | ACP3MEN1KMT2AADRA1DPARP1 | |
| SCHEMBL15695557 | 0.81 | PTGS1 (0.46) | ACP3MEN1KMT2AADRA1DALDH1A1 | |
| SCHEMBL12658713 | 0.81 | ACP3 (0.46) | ACP3MEN1KMT2AADRA1DPARP1 | |
| SCHEMBL20535015 | 0.79 | ACP3 (0.45) | ACP3MEN1KMT2AADRA1DPARP1 | |
| SCHEMBL30826369 | 0.79 | ACP3 (0.45) | ACP3MEN1KMT2AADRA1DPARP1 |
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-1432706-A2 | 3-PYRIDYL OR 4-ISOQUINOLINYL THIAZOLES AS C17,20 LYASE INHIBITORS | Bayer Pharmaceuticals Corporation (US) | 2004-06-30 | — | — | EP | disclosed |
| WO-2003027085-A2 | 3-PYRIDYL OR 4-ISOQUINOLINYL THIAZOLES AS C17,20 LYASE INHIBITORS | BAYER PHARMACEUTICALS CORPORATION (US) | 2003-04-03 | — | — | WO | disclosed |