Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | RXRB | P28702 | 1/20 | 0.41 |
| ▸ | RXRG | P48443 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28821538 | 0.85 | KMT2A (0.47) | KMT2AALDH1A1GAAIRAK4RXRA | |
| SCHEMBL9780575 | 0.85 | PPARG (0.60) | PPARGKMT2AADRA2AADRA2BADRA2C | |
| SCHEMBL9780582 | 0.85 | PPARG (0.60) | PPARGKMT2AADRA2AADRA2BADRA2C | |
| SCHEMBL17164097 | 0.81 | PPARG (0.56) | PPARGADRA2AADRA2BADRA2CRXRA | |
| SCHEMBL14783846 | 0.78 | KMT2A (0.73) | KMT2AALDH1A1GAAIRAK4LMNA | |
| SCHEMBL105728 | 0.77 | ADRA2A (0.53) | PPARGADRA2AADRA2BADRA2CALDH1A1 | |
| SCHEMBL4955094 | 0.76 | PPARG (0.50) | PPARGADRA2AADRA2BADRA2CALDH1A1 | |
| SCHEMBL7077662 | 0.76 | HPGD (0.54) | KMT2AALDH1A1GAAIRAK4HPGD | |
| SCHEMBL4623062 | 0.76 | FPR2 (0.46) | — | |
| SCHEMBL4074998 | 0.75 | ADRA2A (0.46) | PPARGADRA2AADRA2BADRA2CRXRA |
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-2280966-A1 | AZABICYCLO [3.2.1]OCTYL DERIVATIVES AS 11 BETA-HSD1 MODULATORS | Exelixis, Inc. (US) | 2011-02-09 | — | — | EP | claimed |
| WO-2009114173-A1 | AZABICYCLO [3. 2. I] OCTYL DERIVATIVES AS 11 BETA-HSDL MODULATORS | EXELIXIS, INC. (US) | 2009-09-17 | — | — | WO | claimed |