Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | ERN1 | O75460 | 10/20 | 0.53 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.53 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.53 |
| ▸ | TYR | P14679 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TLR2 | O60603 | 1/20 | 0.48 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.48 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.48 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.48 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.48 |
| ▸ | ABAT | P80404 | 1/20 | 0.48 |
| ▸ | PRKDC | P78527 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22635018 | 0.92 | ALDH1A1 (0.69) | ALDH1A1TDP1KDM4ETSHRERN1 | |
| SCHEMBL29730976 | 0.89 | ALDH1A1 (0.65) | ALDH1A1TDP1KDM4ETSHRERN1 | |
| SCHEMBL333221 | 0.89 | ALDH1A1 (0.65) | ALDH1A1TDP1KDM4ETSHRERN1 | |
| SCHEMBL769297 | 0.89 | ALDH1A1 (0.65) | ALDH1A1TDP1KDM4ETSHRERN1 | |
| SCHEMBL6234401 | 0.88 | ERN1 (0.53) | ALDH1A1TDP1KDM4ETSHRERN1 | |
| SCHEMBL1002368 | 0.88 | ALDH1A1 (0.69) | ALDH1A1TDP1KDM4ETSHRERN1 | |
| SCHEMBL29459727 | 0.88 | ALDH1A1 (0.69) | ALDH1A1TDP1KDM4ETSHRERN1 | |
| SCHEMBL10849623 | 0.84 | ALDH1A1 (0.86) | ALDH1A1TDP1KDM4ETSHRERN1 | |
| SCHEMBL15349701 | 0.84 | ERN1 (0.53) | ALDH1A1TDP1KDM4ETSHRERN1 | |
| SCHEMBL3639878 | 0.84 | ERN1 (0.53) | ALDH1A1TDP1KDM4ETSHRERN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5003091-A | Preparation of 3-memory-4,5-methylenedioxybenzaldehyde | RHONE-POULENC CHIMIE (FR) | 1991-03-26 | — | — | US | disclosed |