Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.61 |
| ▸ | RAB9A | P51151 | 3/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.52 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.50 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.48 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.46 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3814593 | 0.82 | KDM4E (0.66) | KDM4ERAB9ALMNASMN1; SMN2CYP19A1 | |
| SCHEMBL3813712 | 0.82 | KDM4E (0.69) | KDM4ERAB9ALMNASMN1; SMN2CYP19A1 | |
| SCHEMBL3815644 | 0.79 | RAB9A (0.54) | KDM4ERAB9ALMNASMN1; SMN2CYP19A1 | |
| SCHEMBL11453481 | 0.79 | CYP1A1 (0.67) | KDM4ERAB9ASMN1; SMN2RXFP1CYP1A1 | |
| SCHEMBL6647162 | 0.79 | KDM4E (0.61) | KDM4ERAB9ALMNASMN1; SMN2CYP19A1 | |
| SCHEMBL6646406 | 0.79 | KDM4E (0.61) | KDM4ERAB9ALMNASMN1; SMN2CYP19A1 | |
| SCHEMBL5049092 | 0.78 | GSK3B (0.49) | SMN1; SMN2CYP1A2NPSR1CYP2E1CYP2C8 | |
| SCHEMBL6647164 | 0.78 | KDM4E (0.59) | KDM4ERAB9ALMNASMN1; SMN2CYP19A1 | |
| SCHEMBL3824243 | 0.77 | KDM4E (0.58) | KDM4ERAB9ALMNASMN1; SMN2CYP19A1 | |
| SCHEMBL4279626 | 0.77 | ALOX5 (0.64) | KDM4ERAB9ALMNASMN1; SMN2CYP19A1 |
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 |