Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 5/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10887701 | 0.81 | ALDH1A1 (0.45) | ALDH1A1GLAPKMTP53TSHR | |
| SCHEMBL25812948 | 0.79 | CA12 (0.53) | ALDH1A1GLAPKMTP53TSHR | |
| SCHEMBL16923006 | 0.76 | ALDH1A1 (0.57) | ALDH1A1GLAPKMTP53TSHR | |
| SCHEMBL3266043 | 0.76 | ALDH1A1 (0.51) | ALDH1A1GLAPKMTP53TSHR | |
| SCHEMBL16922871 | 0.76 | ALDH1A1 (0.51) | ALDH1A1GLAPKMTP53TSHR | |
| SCHEMBL3266050 | 0.76 | ALDH1A1 (0.51) | ALDH1A1GLAPKMTP53TSHR | |
| SCHEMBL34336 | 0.75 | ALDH1A1 (0.53) | ALDH1A1TSHRCYP3A4SMN1; SMN2TDP1 | |
| SCHEMBL3144323 | 0.74 | ALDH1A1 (0.59) | ALDH1A1GLAPKMTP53TSHR | |
| SCHEMBL29847477 | 0.74 | ALDH1A1 (0.59) | ALDH1A1GLAPKMTP53TSHR | |
| SCHEMBL3053185 | 0.74 | PTPN1 (0.51) | ALDH1A1GLAPKMTP53TSHR |
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-105189446-A | Phloroglucinol derivatives and application thereof in treatment of neurodegenerative disorder | INST MATERIA MEDICA CAMS | 2015-12-23 | — | — | CN | disclosed |