Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | C1S | P09871 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | ATP4A | P20648 | 2/20 | 0.44 |
| ▸ | ATP4B | P51164 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3818666 | 0.85 | CYP19A1 (0.55) | CYP19A1L3MBTL1LMNAKMT2AMAPT | |
| SCHEMBL6626985 | 0.84 | SMN1; SMN2 (0.51) | CYP19A1LMNAKMT2AMAPTRAB9A | |
| SCHEMBL6648194 | 0.83 | RAB9A (0.65) | CYP19A1L3MBTL1LMNAKMT2AMAPT | |
| SCHEMBL6648164 | 0.83 | CYP19A1 (0.56) | CYP19A1L3MBTL1LMNAKMT2AMAPT | |
| Hydrochloric Acid SCHEMBL6627345 | 0.83 | SMN1; SMN2 (0.50) | CYP19A1LMNAKMT2AMAPTRAB9A | |
| SCHEMBL6651305 | 0.83 | CYP19A1 (0.56) | CYP19A1L3MBTL1LMNAKMT2AMAPT | |
| SCHEMBL6646978 | 0.82 | CYP19A1 (0.58) | CYP19A1L3MBTL1LMNAKMT2AMAPT | |
| SCHEMBL6648550 | 0.82 | RAB9A (0.63) | CYP19A1L3MBTL1LMNAKMT2AMAPT | |
| SCHEMBL6648165 | 0.81 | CYP19A1 (0.53) | CYP19A1L3MBTL1LMNAKMT2AMAPT | |
| SCHEMBL3821580 | 0.79 | KDM4E (0.61) | CYP19A1LMNAKMT2ARAB9ANPC1 |
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 |