Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE9A | O76083 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | CCR3 | P51677 | 2/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL300549 | 0.91 | THRB (0.41) | POLBRAB9ASMN1; SMN2CCR3 | |
| SCHEMBL176656 | 0.86 | ALDH1A1 (0.44) | PDE9APOLBRAB9ASMN1; SMN2BTK | |
| SCHEMBL300693 | 0.84 | CNR1 (0.40) | POLBCCR3 | |
| SCHEMBL300734 | 0.84 | ALDH1A1 (0.38) | — | |
| SCHEMBL300469 | 0.78 | CYP3A4 (0.40) | — | |
| SCHEMBL300521 | 0.77 | CNR2 (0.43) | — | |
| SCHEMBL300489 | 0.77 | LPAR5 (0.41) | — | |
| SCHEMBL300526 | 0.76 | GLA (0.39) | POLBRAB9ACCR3 | |
| SCHEMBL176706 | 0.76 | THRB (0.47) | POLBRAB9ASMN1; SMN2 | |
| SCHEMBL300546 | 0.76 | VIPR2 (0.36) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1937259-B1 | HEXAHYDRO-CYCLOHEPTAPYRAZOLE CANNABINOID MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2011-11-23 | — | — | EP | claimed |