Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.35 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 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 | |
|---|---|---|---|---|
| Ether SCHEMBL7985620 | 0.97 | ALDH1A1 (0.38) | ALDH1A1THRBRECQLLCKPPARD | |
| Ether SCHEMBL22264689 | 0.82 | ALDH1A1 (0.36) | ALDH1A1THRBTSHRTRPA1 | |
| Ether SCHEMBL8206941 | 0.81 | TP53 (0.40) | ALDH1A1TP53TSHRCHRM1AKR1A1 | |
| Ammonia Solution, Strong SCHEMBL28812796 | 0.81 | — | — | |
| Ammonia Solution, Strong SCHEMBL27970528 | 0.81 | — | — | |
| Ether SCHEMBL7265587 | 0.80 | LMNA (0.36) | ALDH1A1TP53TSHRCHRM1AKR1A1 | |
| Lactic Acid SCHEMBL1237356 | 0.79 | TP53 (0.61) | ALDH1A1TP53TSHRCHRM1AKR1A1 | |
| SCHEMBL2023600 | 0.78 | LMNA (0.57) | ALDH1A1THRBRECQLLCKPPARD | |
| Ether SCHEMBL29058438 | 0.78 | ALDH1A1 (0.43) | ALDH1A1THRBTSHRHDAC1HDAC2 | |
| SCHEMBL233072 | 0.78 | — | — |
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-6638349-B2 | Reaction product of the simultaneous reaction of a halogenated carboxylic acid, a fatty acid and a polyamine; acid equivalents are equal to those of amines | ATKINSON GEORGE K (US) | 2003-10-28 | — | — | US | disclosed |
| US-20020129742-A1 | Surface treatments for pigments providing improved dispersibility and exhibiting biocidal activity | GEORGE K ATKINSON (US) | 2002-09-19 | — | — | US | disclosed |