Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.39 |
| ▸ | EIF4E | P06730 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.36 |
| ▸ | AXL | P30530 | 1/20 | 0.36 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.36 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.36 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6627147 | 0.81 | KDM4E (0.55) | KDM4EKMT2ACYP19A1ALDH1A1AXL | |
| SCHEMBL6651242 | 0.81 | SCN9A (0.42) | EIF4EKDM4ECYP19A1SCN9AAR | |
| SCHEMBL6649421 | 0.80 | KDM4E (0.50) | KDM4EMEN1KMT2ACYP19A1SCN9A | |
| SCHEMBL6650983 | 0.79 | CYP19A1 (0.49) | CDK5CDK5R1EIF4EKDM4EMEN1 | |
| SCHEMBL6651514 | 0.78 | RAB9A (0.46) | KDM4EMEN1KMT2AL3MBTL1CYP19A1 | |
| SCHEMBL6647943 | 0.76 | KDM4E (0.43) | CDK5CDK5R1EIF4EKDM4EMEN1 | |
| SCHEMBL6649186 | 0.75 | RAB9A (0.57) | EIF4EKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL6647939 | 0.75 | SREBF2 (0.41) | CDK5CDK5R1EIF4EKDM4EMEN1 | |
| SCHEMBL6646480 | 0.74 | CYP17A1 (0.58) | CDK5CDK5R1EIF4EKDM4EMEN1 | |
| SCHEMBL6627829 | 0.74 | KDM4E (0.59) | KDM4EMEN1KMT2ACYP19A1ALDH1A1 |
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 |