Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.36 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.31 |
| ▸ | APAF1 | O14727 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | RAD52 | P43351 | 1/20 | 0.31 |
| ▸ | CASP6 | P55212 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2781069 | 0.83 | ALDH1A1 (0.38) | ALDH1A3ALDH1A1ALDH3A1PDK2HDAC3 | |
| SCHEMBL13372219 | 0.83 | ALDH1A1 (0.37) | ALDH1A3ALDH1A1ALDH3A1PDK2CYP2A6 | |
| SCHEMBL14427916 | 0.81 | ALDH1A1 (0.35) | ALDH1A3ALDH1A1ALDH3A1PDK2CYP2A6 | |
| SCHEMBL14427943 | 0.79 | PDK2 (0.36) | ALDH1A3ALDH1A1ALDH3A1PDK2CYP2A6 | |
| SCHEMBL19052322 | 0.79 | IP6K1 (0.38) | ALDH1A3ALDH1A1ALDH3A1PDK2CYP2A6 | |
| SCHEMBL28355417 | 0.77 | MMP2 (0.36) | ALDH1A3ALDH1A1ALDH3A1HDAC3HDAC1 | |
| SCHEMBL6775885 | 0.77 | MMP2 (0.36) | ALDH1A3ALDH1A1ALDH3A1HDAC3HDAC1 | |
| SCHEMBL14427946 | 0.77 | ALDH1A1 (0.33) | ALDH1A3ALDH1A1ALDH3A1PDK2CYP2A6 | |
| SCHEMBL13357071 | 0.76 | PDK2 (0.39) | ALDH1A3ALDH1A1ALDH3A1PDK2CYP2A6 | |
| SCHEMBL13805748 | 0.75 | ALDH1A1 (0.40) | ALDH1A3ALDH1A1ALDH3A1PDK2CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102712663-A | Novel organic electroluminescent compounds and organic electroluminescent device using the same | DOW ADVANCED DISPLAY MAT LTD | 2012-10-03 | — | — | CN | disclosed |