Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.34 |
| ▸ | ADH1B | P00325 | 1/20 | 0.33 |
| ▸ | ADH1A | P07327 | 1/20 | 0.33 |
| ▸ | ADH7 | P40394 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12216275 | 0.92 | ALDH1A1 (0.35) | ALDH1A1TSHRPAOXADH1BADH1A | |
| SCHEMBL65964 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL7524957 | 0.88 | — | — | |
| SCHEMBL15261003 | 0.88 | — | — | |
| Hydrogen Sulfide SCHEMBL28136056 | 0.88 | — | — | |
| Formic Acid SCHEMBL5392249 | 0.81 | — | — | |
| SCHEMBL4961720 | 0.78 | — | — | |
| SCHEMBL15445 | 0.77 | — | — | |
| SCHEMBL17626634 | 0.77 | TSHR (0.53) | ALDH1A1TSHRPAOXADH1BADH1A | |
| SCHEMBL2711856 | 0.74 | ALDH1A1 (0.31) | ALDH1A1TSHR |
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-5965785-A | INHIBITING CORROSION IN SYSTEMS OF CONDENSING HYDROCARBONS WHICH CONTAIN WATER AND CHLORIDES BY FEEDING AQUEOUS BLEND OF AMINES COMPRISING 2-AMINO-1-METHOXYPROPANE, SEC-BUTYLAMINE, N-BUTYLAMINE, DIPROPYLAMINE AND MONOAMYLAMINE | NALCO/EXXON ENERGY CHEMICALS, L.P. (US) | 1999-10-12 | — | — | US | disclosed |