Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.43 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL5202615 | 0.96 | ALDH1A1 (0.43) | ALDH1A1ITGA4ITGB7CNR1KCNA5 | |
| SCHEMBL5200569 | 0.86 | TRPA1 (0.46) | ALDH1A1TRPA1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL5203380 | 0.85 | HDAC4 (0.42) | CNR1IDO1TRPA1CYP3A4CYP2C8 | |
| SCHEMBL4823270 | 0.81 | CNR1 (0.58) | ALDH1A1ITGA4ITGB7CNR1 | |
| SCHEMBL5264331 | 0.80 | LMNA (0.52) | CNR1KCNA5CYP2C9CYP2C19SMN1; SMN2 | |
| SCHEMBL4831230 | 0.79 | CNR1 (0.53) | ALDH1A1ITGA4ITGB7CNR1 | |
| SCHEMBL14064694 | 0.79 | CNR1 (0.53) | ALDH1A1ITGA4ITGB7CNR1 | |
| SCHEMBL4827955 | 0.77 | CNR1 (0.60) | ITGA4ITGB7CNR1 | |
| Trifluoroacetic Acid SCHEMBL4831441 | 0.76 | CNR1 (0.53) | ALDH1A1ITGA4ITGB7CNR1 | |
| SCHEMBL5205537 | 0.76 | HDAC4 (0.42) | ALDH1A1TRPA1SMN1; SMN2LMNAP2RX7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1490043-A4 | SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS | MERCK & CO INC (US) | 2007-05-30 | — | — | EP | disclosed |
| EP-1490043-A2 | SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS | Merck & Co., Inc. (US) | 2004-12-29 | — | — | EP | disclosed |
| WO-2003082190-A2 | SPIROCYCLIC AMIDES AS CANNABINOID RECEPTOR MODULATORS | MERCK & CO., INC. (US) | 2003-10-09 | — | — | WO | disclosed |