Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | SCN4A | P35499 | 3/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.30 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.30 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.30 |
| ▸ | GBA1 | P04062 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL21835934 | 1.00 | ALDH1A1 (0.38) | ALDH1A1HSD17B10TSHROPRM1THRB | |
| Bicarbonate SCHEMBL8842724 | 0.89 | ALDH1A1 (0.43) | ALDH1A1HSD17B10TSHRTHRBTDP1 | |
| SCHEMBL194541 | 0.89 | ALDH1A1 (0.39) | ALDH1A1HSD17B10TSHRTDP1SCN4A | |
| SCHEMBL90270 | 0.86 | — | — | |
| SCHEMBL12695269 | 0.86 | ALDH1A1 (0.37) | ALDH1A1HSD17B10TSHRTDP1SCN4A | |
| SCHEMBL310965 | 0.86 | — | — | |
| SCHEMBL89817 | 0.86 | — | — | |
| SCHEMBL12269417 | 0.86 | ALDH1A1 (0.37) | ALDH1A1HSD17B10TSHRTDP1SCN4A | |
| Hydrochloric Acid SCHEMBL14738782 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL9110246 | 0.83 | — | — |
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-11643501-B2 | Oxidizing, ionic and short oil alkyd resins for coatings with excellent balance of hardness and gloss | COVESTRO (NETHERLANDS) B.V. (NL) | 2023-05-09 | — | — | US | disclosed |