Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.65 |
| ▸ | MAPT | P10636 | 7/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.57 |
| ▸ | RAB9A | P51151 | 6/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.57 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.56 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.54 |
| ▸ | AR | P10275 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | ATM | Q13315 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 5/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.51 |
| ▸ | RELA | Q04206 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL6648655 | 0.87 | KDM4E (0.71) | CYP19A1KDM4ERAB9ASMN1; SMN2NPC1 | |
| SCHEMBL6693465 | 0.82 | MAPT (0.75) | CYP19A1MAPTKDM4ERAB9ASMN1; SMN2 | |
| SCHEMBL12443403 | 0.82 | CYP19A1 (0.90) | CYP19A1MAPTKDM4ERAB9ASMN1; SMN2 | |
| SCHEMBL13458065 | 0.81 | MAPT (0.73) | CYP19A1MAPTKDM4ERAB9ASMN1; SMN2 | |
| SCHEMBL6628490 | 0.80 | CYP19A1 (0.58) | CYP19A1MAPTKDM4ERAB9ASMN1; SMN2 | |
| SCHEMBL4279334 | 0.80 | KDM4E (0.75) | CYP19A1MAPTKDM4ERAB9ASMN1; SMN2 | |
| SCHEMBL6649613 | 0.79 | CYP19A1 (0.59) | CYP19A1MAPTKDM4ERAB9ASMN1; SMN2 | |
| SCHEMBL6628492 | 0.79 | SREBF2 (0.61) | CYP19A1MAPTKDM4ERAB9ASMN1; SMN2 | |
| SCHEMBL6646512 | 0.78 | MAPT (0.55) | CYP19A1MAPTKDM4ERAB9ASMN1; SMN2 | |
| SCHEMBL6648628 | 0.78 | CYP19A1 (0.60) | CYP19A1MAPTKDM4ERAB9ASMN1; SMN2 |
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 |