Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.48 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.48 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.48 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29483473 | 1.00 | SIGMAR1 (0.55) | SIGMAR1TSHRSMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL5661589 | 0.92 | SIGMAR1 (0.57) | SIGMAR1TSHRALDH1A1TMEM97KDM4E | |
| SCHEMBL29572755 | 0.92 | SIGMAR1 (0.57) | SIGMAR1TSHRALDH1A1TMEM97KDM4E | |
| SCHEMBL29483476 | 0.85 | ALDH1A1 (0.60) | SIGMAR1TSHRSMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL28743846 | 0.85 | ALDH1A1 (0.60) | SIGMAR1TSHRSMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL29483475 | 0.82 | BRD4 (0.55) | TSHRSMN1; SMN2ALDH1A1KDM4EMEN1 | |
| SCHEMBL28642771 | 0.82 | BRD4 (0.55) | TSHRSMN1; SMN2ALDH1A1KDM4EMEN1 | |
| SCHEMBL1461825 | 0.80 | HDAC1 (0.63) | TSHRALDH1A1MAPK1L3MBTL1KDM4E | |
| SCHEMBL29483474 | 0.80 | HDAC1 (0.63) | TSHRALDH1A1MAPK1L3MBTL1KDM4E | |
| SCHEMBL16693159 | 0.80 | KDM4E (0.59) | TSHRSMN1; SMN2ALDH1A1MAPK1L3MBTL1 |
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-112812060-B | Arylation method of tetrahydroquinoline | 绍兴文理学院 | 2022-04-29 | — | — | CN | disclosed |
| CN-112812060-A | Arylation method of tetrahydroquinoline | 绍兴文理学院 | 2021-05-18 | — | — | CN | disclosed |