Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | TSHR | P16473 | 4/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.60 |
| ▸ | BLM | P54132 | 2/20 | 0.60 |
| ▸ | ATM | Q13315 | 2/20 | 0.60 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.60 |
| ▸ | USP2 | O75604 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | GABBR2 | O75899 | 2/20 | 0.47 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28285750 | 0.79 | TAAR1 (0.47) | ALDH1A1MEN1KMT2ACYP1A2CYP3A4 | |
| Acetic Acid SCHEMBL28284236 | 0.76 | CYP1A2 (0.45) | ALDH1A1KMT2ACYP1A2CYP3A4MAPK1 | |
| SCHEMBL2372640 | 0.76 | ALDH1A1 (1.00) | ALDH1A1TSHRMEN1KMT2ACYP1A2 | |
| SCHEMBL11264836 | 0.76 | ALDH1A1 (0.58) | ALDH1A1TSHRMEN1KMT2ACYP1A2 | |
| SCHEMBL11268104 | 0.72 | ALDH1A1 (0.73) | ALDH1A1TSHRMEN1KMT2ACYP1A2 | |
| SCHEMBL11266501 | 0.72 | ALDH1A1 (0.68) | ALDH1A1TSHRMEN1KMT2ACYP1A2 | |
| SCHEMBL8145952 | 0.72 | GAA (0.55) | ALDH1A1TSHRMEN1KMT2ACYP1A2 | |
| SCHEMBL28653743 | 0.72 | ALDH1A1 (0.43) | ALDH1A1MEN1KMT2ACYP3A4CYP2D6 | |
| SCHEMBL28669254 | 0.72 | PTPRC (0.36) | TSHRKMT2ACYP1A2CYP3A4MAPK1 | |
| SCHEMBL28654764 | 0.72 | SLC6A2 (0.46) | MEN1KMT2ACYP1A2MAPK1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4317933-A | ALKYLATING TO PRODUCE AN ALDEHYDE SUBSTITUTED PHENOL, ESTERS THEREOF | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1982-03-02 | — | — | US | disclosed |
| US-4091225-A | ALKYLATION, REDUCTION, TRANSESTERIFICATION | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1978-05-23 | — | — | US | disclosed |