Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.39 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.39 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.39 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.39 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.39 |
| ▸ | CYP4F8 | P98187 | 1/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 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 | |
|---|---|---|---|---|
| SCHEMBL3917534 | 0.88 | CYP3A4 (0.39) | CYP3A4CYP1A1CYP1A2CYP2E1CYP2C8 | |
| SCHEMBL3911204 | 0.82 | BRAF (0.42) | CYP3A4CYP1A1CYP1A2CYP2E1CYP2C8 | |
| SCHEMBL3917686 | 0.81 | CCNT1 (0.44) | CYP3A4CYP1A1CYP1A2CYP2E1CYP2C8 | |
| SCHEMBL3914041 | 0.81 | PTGS2 (0.38) | KMT2AKDM4ETP53HPGDSMN1; SMN2 | |
| SCHEMBL3916582 | 0.79 | BRAF (0.44) | CYP3A4CYP1A1CYP1A2CYP2E1CYP2C8 | |
| SCHEMBL3250098 | 0.78 | MAPT (0.39) | CYP3A4CYP1A2CYP2C9CYP2C19JAK3 | |
| SCHEMBL3912471 | 0.78 | CCNT1 (0.39) | CYP3A4CYP1A1CYP1A2CYP2E1CYP2C8 | |
| SCHEMBL3911904 | 0.77 | ROS1 (0.45) | CYP3A4CYP1A1CYP1A2CYP2E1CYP2C8 | |
| SCHEMBL3921214 | 0.74 | BRAF (0.46) | BRAFTEK | |
| SCHEMBL14947685 | 0.72 | DYRK1B (0.41) | CYP3A4BRAFEGFRJAK3MAPK10 |
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-2024353-A2 | PYRAZOLE COMPOUNDS | Pfizer Products Inc. (US) | 2009-02-18 | — | — | EP | disclosed |
| WO-2007105058-A2 | PYRAZOLE COMPOUNDS | PFIZER PRODUCTS INC. (US) | 2007-09-20 | — | — | WO | disclosed |