Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR52 | Q9Y2T5 | 8/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27892637 | 0.92 | GPR52 (0.45) | GPR52ALDH1A1KDM4EHDAC8PDE4A | |
| Allylbenzene SCHEMBL27875949 | 0.86 | ALDH1A1 (0.43) | ALDH1A1KDM4ETSHRPDE4BPDE4D | |
| SCHEMBL28006642 | 0.84 | GPR52 (0.51) | GPR52ALDH1A1KDM4E | |
| SCHEMBL27520125 | 0.83 | ALDH1A1 (0.41) | ALDH1A1KDM4ETSHRPOLBNR1H4 | |
| Phenylethyl Alcohol SCHEMBL28016810 | 0.83 | TDP1 (0.48) | GPR52ALDH1A1KDM4EHDAC8PARK7 | |
| Phenethylamine SCHEMBL27459899 | 0.82 | HTR2A (0.47) | GPR52ALDH1A1KDM4EHDAC8PARK7 | |
| Propene SCHEMBL27261898 | 0.79 | TSHR (0.46) | ALDH1A1KDM4ETSHRPOLBNR1H4 | |
| Benzene SCHEMBL27546363 | 0.79 | KDM4E (0.55) | ALDH1A1KDM4ETSHRNR1H4HPGD | |
| SCHEMBL28058314 | 0.79 | GPR52 (0.49) | GPR52ALDH1A1TSHR | |
| Styrene SCHEMBL27479469 | 0.79 | ALDH1A1 (0.46) | ALDH1A1KDM4ETSHRNR1H4HPGD |
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-102731722-B | For the production of the method for modified conjugated diene polymer, modified conjugated diene polymer and polymer composition | SUMITOMO CHEMICAL CO., LTD. (JP) | 2016-03-16 | — | — | CN | disclosed |