Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.45 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.45 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMO | O15229 | 1/20 | 0.39 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SI | P14410 | 1/20 | 0.39 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 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 | |
|---|---|---|---|---|
| SCHEMBL21852336 | 0.85 | MEN1 (0.47) | TSHRALDH1A1MAPTGAA | |
| SCHEMBL29816406 | 0.85 | MEN1 (0.47) | TSHRALDH1A1MAPTGAA | |
| SCHEMBL2097486 | 0.85 | GSK3B (0.53) | CYP1A2CYP3A4CYP2C9CYP2C19TAS1R3 | |
| SCHEMBL24404054 | 0.84 | KDM4E (0.54) | CYP1A2CYP3A4CYP2C9CYP2C19TAS1R3 | |
| SCHEMBL11536711 | 0.84 | KMT2A (0.58) | CYP1A2CYP3A4CYP2C9CYP2C19MCL1 | |
| SCHEMBL11392489 | 0.83 | TSHR (0.55) | TSHRALDH1A1KMOHDAC3HDAC4 | |
| SCHEMBL29269279 | 0.82 | ESR1 (0.41) | CYP1A2CYP3A4CYP2C9CYP2C19MAPT | |
| SCHEMBL2278168 | 0.81 | CYP3A4 (0.52) | CYP1A2CYP3A4CYP2C9CYP2C19TAS1R3 | |
| SCHEMBL27778655 | 0.81 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C9CYP2C19TAS1R3 | |
| SCHEMBL10897477 | 0.80 | HSD17B3 (0.57) | CYP1A2CYP3A4CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-6916838-B1 | 1-benzylpyrazole-3-carboxylic acid tricyclic derivatives as cannabinoid receptor antagonists | SANOFI-AVENTIS (FR) | 2005-07-12 | — | — | US | disclosed |
| EP-1230222-B1 | 1-BENZYLPYRAZOLES-3-CARBOXYLIC ACID TRICYCLIC DERIVATIVES AS CANNABINOID RECEPTOR ANTAGONISTS | SANOFI SYNTHELABO (FR) | 2004-07-07 | — | — | EP | disclosed |
| EP-1230222-A1 | 1-BENZYLPYRAZOLES-3-CARBOXYLIC ACID TRICYCLIC DERIVATIVES AS CANNABINOID RECEPTOR ANTAGONISTS | SANOFI-SYNTHELABO (FR) | 2002-08-14 | — | — | EP | disclosed |
| WO-2001032629-A1 | 1-BENZYLPYRAZOLES-3-CARBOXYLIC ACID TRICYCLIC DERIVATIVES AS CANNABINOID RECEPTOR ANTAGONISTS | SANOFI-SYNTHELABO (FR) | 2001-05-10 | — | — | WO | disclosed |