Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.49 |
| ▸ | CDC25A | P30304 | 1/20 | 0.49 |
| ▸ | CDC25B | P30305 | 1/20 | 0.49 |
| ▸ | CDC25C | P30307 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | EIF4E | P06730 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 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 | |
|---|---|---|---|---|
| SCHEMBL6648507 | 0.87 | KDM4E (0.53) | KDM4ERAB9ASMN1; SMN2NPC1CYP19A1 | |
| SCHEMBL6647162 | 0.84 | KDM4E (0.61) | KDM4ERAB9ASMN1; SMN2NPC1CYP19A1 | |
| SCHEMBL6649082 | 0.84 | KDM4E (0.61) | GAAKDM4ERAB9ASMN1; SMN2NPC1 | |
| SCHEMBL6651724 | 0.84 | GAA (0.57) | GAACYP1A1CYP1B1CDC25ACDC25B | |
| SCHEMBL6647407 | 0.83 | KDM4E (0.59) | KDM4ERAB9ASMN1; SMN2NPC1CYP19A1 | |
| SCHEMBL6628490 | 0.81 | CYP19A1 (0.58) | CYP1A1CYP1B1CDC25ACDC25BKDM4E | |
| SCHEMBL6646446 | 0.81 | KDM4E (0.55) | KDM4ERAB9ASMN1; SMN2NPC1CYP19A1 | |
| SCHEMBL6649095 | 0.80 | GAA (0.49) | GAACYP1A1CYP1B1CDC25ACDC25B | |
| SCHEMBL6648609 | 0.79 | CYP19A1 (0.44) | KDM4ERAB9ASMN1; SMN2NPC1CYP19A1 | |
| SCHEMBL6626301 | 0.78 | CDC25A (0.49) | GAACYP1A1CYP1B1CDC25ACDC25B |
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 |