Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL28004703 | 0.87 | TSHR (0.56) | ALDH1A1TDP1L3MBTL1SMN1; SMN2HTT | |
| SCHEMBL1066576 | 0.83 | TSHR (0.67) | ALDH1A1TDP1L3MBTL1SMN1; SMN2TSHR | |
| SCHEMBL755347 | 0.82 | ALDH1A1 (0.69) | ALDH1A1TDP1L3MBTL1SMN1; SMN2HTT | |
| Acetone SCHEMBL27310709 | 0.81 | ALDH1A1 (0.57) | ALDH1A1TDP1L3MBTL1SMN1; SMN2TSHR | |
| Hydrochloric Acid SCHEMBL1409425 | 0.81 | TSHR (0.64) | ALDH1A1TDP1L3MBTL1TSHRESR1 | |
| Water SCHEMBL28780406 | 0.81 | TSHR (0.64) | ALDH1A1TDP1L3MBTL1TSHRESR1 | |
| SCHEMBL17459104 | 0.81 | ALDH1A1 (0.67) | ALDH1A1TDP1L3MBTL1SMN1; SMN2HTT | |
| Phenol SCHEMBL28177872 | 0.80 | TSHR (0.56) | TDP1L3MBTL1SMN1; SMN2HTTTSHR | |
| SCHEMBL16732162 | 0.79 | SMN1; SMN2 (0.51) | ALDH1A1TDP1L3MBTL1SMN1; SMN2HTT | |
| SCHEMBL17459122 | 0.79 | ALDH1A1 (0.58) | ALDH1A1TDP1L3MBTL1SMN1; SMN2TSHR |
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-105849111-A | Pyranochromenyl phenol derivative, and pharmaceutical composition for treating metabolic syndrome or inflammatory disease | 依如睦生物科技株式会社 | 2016-08-10 | — | — | CN | disclosed |