Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.39 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.39 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.39 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.38 |
| ▸ | APLNR | P35414 | 1/20 | 0.38 |
| ▸ | GABRP | O00591 | 1/20 | 0.38 |
| ▸ | GABRD | O14764 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15129665 | 1.00 | CYP2C19 (0.41) | CYP2C19GABRR1CYP2D6CYP1A2ALOX15 | |
| SCHEMBL31162423 | 1.00 | CYP2C19 (0.41) | CYP2C19GABRR1CYP2D6CYP1A2ALOX15 | |
| Hydrochloric Acid SCHEMBL11818531 | 0.97 | CYP2C19 (0.39) | CYP2C19GABRR1CYP2D6CYP1A2ALOX15 | |
| SCHEMBL25348287 | 0.84 | GABRR1 (0.40) | CYP2C19GABRR1CYP2D6CYP1A2ALOX15 | |
| SCHEMBL3489126 | 0.84 | GABRR1 (0.40) | CYP2C19GABRR1CYP2D6CYP1A2ALOX15 | |
| SCHEMBL691392 | 0.84 | GABRR1 (0.46) | CYP2C19GABRR1CYP2D6CYP1A2ALOX15 | |
| SCHEMBL1860320 | 0.84 | GABRR1 (0.40) | CYP2C19GABRR1CYP2D6CYP1A2ALOX15 | |
| SCHEMBL20602646 | 0.84 | GABRR1 (0.40) | CYP2C19GABRR1CYP2D6CYP1A2ALOX15 | |
| SCHEMBL31162246 | 0.84 | GABRR1 (0.40) | CYP2C19GABRR1CYP2D6CYP1A2ALOX15 | |
| SCHEMBL31162259 | 0.84 | GABRR1 (0.40) | CYP2C19GABRR1CYP2D6CYP1A2ALOX15 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4355733-A1 | SUBSTITUTED PYRAZOLE AMIDES | Grünenthal GmbH (DE) | 2024-04-24 | — | — | EP | disclosed |
| EP-3644992-B1 | 3-(1H-PYRAZOL-4-YL)PYRIDINE ALLOSTERIC MODULATORS OF THE M4 MUSCARINIC ACETYLCHOLINE RECEPTOR | MERCK SHARP & DOHME LLC (US) | 2023-03-29 | — | — | EP | disclosed |
| WO-2022263498-A1 | SUBSTITUTED PYRAZOLE AMIDES | Grünenthal GmbH (DE) | 2022-12-22 | — | — | WO | disclosed |
| WO-2019000236-A1 | 3-(1H-PYRAZOL-4-YL)PYRIDINE ALLOSTERIC MODULATORS OF M4 MUSCARINIC ACETYLCHOLINE RECEPTOR | MERCK SHARP & DOHME CORP. (US) | 2019-01-03 | — | — | WO | disclosed |