Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ALB | P02768 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.39 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.39 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.39 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.39 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.39 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.39 |
| ▸ | LIMK1 | P53667 | 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 | |
|---|---|---|---|---|
| SCHEMBL11785830 | 0.85 | POLB (0.47) | PPARGALDH1A1CYP2C9LMNATSHR | |
| SCHEMBL20983506 | 0.83 | MCHR1 (0.39) | CNR2MCHR1PPARGALDH1A1CYP2C9 | |
| SCHEMBL11790689 | 0.78 | MCHR1 (0.52) | CNR2MCHR1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL20983531 | 0.78 | CNR2 (0.44) | CNR2MCHR1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL20983511 | 0.77 | GFER (0.40) | CNR2PPARGALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL28782984 | 0.74 | MCHR1 (0.44) | CNR2MCHR1ALDH1A1CYP2C9TDP1 | |
| SCHEMBL28239200 | 0.74 | APP (0.40) | PPARGALDH1A1CYP2C9LMNATSHR | |
| SCHEMBL11785484 | 0.73 | PPARG (0.43) | PPARGALDH1A1LMNAPOLBSTAT3 | |
| Bicarbonate SCHEMBL27670239 | 0.73 | STAT3 (0.48) | MCHR1PPARGALDH1A1CYP2C9TDP1 | |
| SCHEMBL3694171 | 0.72 | CNR2 (0.58) | CNR2MCHR1ALDH1A1TDP1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2227087-A1 | CBI DERIVATIVES SUBJECT TO REDUCTIVE ACTIVATION | The Scripps Research Institute (US) | 2010-09-15 | — | — | EP | disclosed |
| WO-2009064908-A1 | CBI DERIVATIVES SUBJECT TO REDUCTIVE ACTIVATION | THE SCRIPPS RESEARCH INSTITUTE (US) | 2009-05-22 | — | — | WO | disclosed |