Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.41 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | NCF1 | P14598 | 1/20 | 0.37 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6758512 | 0.81 | CYP1A2 (0.43) | CYP1A2CYSLTR1CYSLTR2PDE10AKDM4E | |
| Hydrochloric Acid SCHEMBL6751614 | 0.79 | CYP1A2 (0.42) | CYP1A2CYSLTR1CYSLTR2PDE10AKDM4E | |
| SCHEMBL6761970 | 0.77 | CYP1A2 (0.43) | CYP1A2CYSLTR1CYSLTR2PDE10AKDM4E | |
| SCHEMBL6751584 | 0.73 | ALDH1A1 (0.39) | CYP1A2CYSLTR1CYSLTR2PDE10AKDM4E | |
| SCHEMBL153778 | 0.73 | CYSLTR1 (0.53) | CYP1A2CYSLTR1CYSLTR2PDE10ANCF1 | |
| SCHEMBL29405396 | 0.73 | CYSLTR1 (0.53) | CYP1A2CYSLTR1CYSLTR2PDE10ANCF1 | |
| Hydrochloric Acid SCHEMBL28245253 | 0.71 | CYSLTR1 (0.52) | CYP1A2CYSLTR1CYSLTR2PDE10ANCF1 | |
| Iodide SCHEMBL28612904 | 0.71 | CYSLTR1 (0.52) | CYP1A2CYSLTR1CYSLTR2PDE10ANCF1 | |
| Ammonia Solution, Strong SCHEMBL28282609 | 0.71 | CYSLTR1 (0.52) | CYP1A2CYSLTR1CYSLTR2PDE10ANCF1 | |
| Hydrochloric Acid SCHEMBL5197438 | 0.71 | CYSLTR1 (0.52) | CYP1A2CYSLTR1CYSLTR2PDE10ANCF1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6723675-B1 | IMPREGNATING OR SPRAY-DRYING CATALYST COMPOUND COMPRISING GROUP 4, 5, 6 TRANSITION METAL COMPLEX ON SUPPORT | UNIVATION TECHNOLOGIES, LLC | 2004-04-20 | — | — | US | disclosed |
| WO-2001092346-A2 | CATALYST FOR THE PRODUCTION OF OLEFIN POLYMERS | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) | 2001-12-06 | — | — | WO | disclosed |