Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 2/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | BAX | Q07812 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.42 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP3 | P08254 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL349007 | 0.86 | AKR1C1 (0.58) | PARP10SRD5A2LTA4HNR1H2BAX | |
| SCHEMBL2722547 | 0.83 | AKR1C1 (0.57) | SMN1; SMN2AKR1C1HTTKMT2AOPRL1 | |
| SCHEMBL501923 | 0.83 | AKR1C1 (0.57) | SMN1; SMN2AKR1C1HTTKMT2AOPRL1 | |
| Hydrochloric Acid SCHEMBL1804765 | 0.81 | AKR1C1 (0.55) | AKR1C1KMT2AOPRL1 | |
| SCHEMBL30662077 | 0.80 | AKR1C1 (0.46) | LMNAAKR1C1OPRL1 | |
| SCHEMBL1480336 | 0.79 | LMNA (0.55) | PARP10SMN1; SMN2MAOALMNAALDH1A1 | |
| SCHEMBL11736962 | 0.76 | NPC1 (0.45) | SMN1; SMN2LMNAAKR1C1KMT2AFFAR1 | |
| SCHEMBL4558687 | 0.76 | FFAR1 (0.47) | MAOALMNAAKR1C1FFAR1OPRL1 | |
| SCHEMBL2184245 | 0.76 | AKR1C1 (0.64) | SMN1; SMN2LMNAAKR1C1HTTALDH1A1 | |
| SCHEMBL42114 | 0.76 | AKR1C1 (0.70) | SMN1; SMN2LMNAAKR1C1HTTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108003054-A | A kind of chrysanthemum amide compound containing diphenyl ether and preparation method and application | 河北大学 | 2018-05-08 | — | — | CN | disclosed |
| CN-108003054-A | A kind of chrysanthemum amide compound containing diphenyl ether and preparation method and application | 河北大学 | 2018-05-08 | — | — | CN | disclosed |