Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16393627 | 0.90 | BRD4 (0.51) | BRD4PTGS2ADRA2AADRA1DADRA1A | |
| Methyl Alcohol SCHEMBL27626456 | 0.88 | BRD4 (0.51) | BRD4PTGS2ADRA2AADRA1DADRA1A | |
| Hydrogen Sulfide SCHEMBL27539552 | 0.88 | BRD4 (0.50) | BRD4PTGS2ADRA2AADRA1DADRA1A | |
| Ammonia Solution, Strong SCHEMBL27714733 | 0.88 | BRD4 (0.50) | BRD4PTGS2ADRA2AADRA1DADRA1A | |
| Hydrogen Sulfide SCHEMBL27869470 | 0.82 | BRD4 (0.46) | BRD4PTGS2ADRA2AADRA1DADRA1A | |
| Boric Acid SCHEMBL29723852 | 0.82 | BRD4 (0.46) | BRD4PTGS2ADRA2AADRA1DADRA1A | |
| SCHEMBL10789751 | 0.82 | PTGS2 (0.60) | BRD4PTGS2ADRA2AADRA1DADRA1A | |
| SCHEMBL28228917 | 0.82 | PTGS2 (0.56) | BRD4PTGS2ADRA2AADRA1DADRA1A | |
| SCHEMBL29433489 | 0.82 | PTGS2 (0.60) | BRD4PTGS2ADRA2AADRA1DADRA1A | |
| SCHEMBL10091277 | 0.81 | PDK2 (0.36) | BRD4PTGS2CHRNB2CHRNA4PDK2 |
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-105503961-A | A series of PHOLED (phosphorescent organic light-emitting diode) materials | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO LTD | 2016-04-20 | — | — | CN | disclosed |