Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | POLQ | O75417 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3717258 | 0.84 | ALDH1A1 (0.48) | POLBPOLQKDM4EALDH1A1EPHX2 | |
| SCHEMBL29718585 | 0.83 | POLQ (0.61) | POLBPOLQKDM4EMEN1KMT2A | |
| SCHEMBL187791 | 0.83 | POLQ (0.61) | POLBPOLQKDM4EMEN1KMT2A | |
| SCHEMBL28013327 | 0.83 | POLB (0.55) | POLBPOLQKDM4EMEN1KMT2A | |
| SCHEMBL7011988 | 0.81 | POLQ (0.51) | POLBPOLQKDM4EMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL2529825 | 0.81 | POLQ (0.59) | POLBPOLQKDM4EMEN1KMT2A | |
| SCHEMBL6953783 | 0.81 | PLOD2 (0.46) | POLBPOLQKDM4EMEN1KMT2A | |
| SCHEMBL6864363 | 0.81 | POLQ (0.58) | POLBPOLQKDM4EMEN1KMT2A | |
| SCHEMBL7196858 | 0.80 | MAPT (0.61) | KDM4EMEN1KMT2AALDH1A1TDP1 | |
| SCHEMBL3862724 | 0.80 | POLQ (0.58) | POLBPOLQKDM4EMEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113388646-B | Method for synthesizing (R) -1- [3,5-bis (trifluoromethyl) ] phenethyl alcohol by catalysis of optical enzyme system | 杭州师范大学 | 2022-10-21 | — | — | CN | disclosed |
| EP-2414332-A1 | ACRYLAMIDE COMPOUNDS AND THE USE THEREOF | Shionogi & Co., Ltd. (JP) | 2012-02-08 | — | — | EP | disclosed |
| WO-2010114181-A1 | ACRYLAMIDE COMPOUNDS AND THE USE THEREOF | SHIONOGI & CO., LTD. (JP) | 2010-10-07 | — | — | WO | disclosed |
| CN-1257153-C | Novel propargylether derivatives | SINGTENTA PARTICIPATION AG (CH) | 2006-05-24 | — | — | CN | disclosed |
| CN-1336912-A | Novel propargylether derivatives | SINGTENTA PARTICIPATION AG (CH) | 2002-02-20 | — | — | CN | disclosed |