Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 7/20 | 0.67 |
| ▸ | CA12 | O43570 | 1/20 | 0.67 |
| ▸ | CA1 | P00915 | 1/20 | 0.67 |
| ▸ | CA2 | P00918 | 1/20 | 0.67 |
| ▸ | CA3 | P07451 | 1/20 | 0.67 |
| ▸ | TYR | P14679 | 1/20 | 0.67 |
| ▸ | DRD1 | P21728 | 1/20 | 0.67 |
| ▸ | CA4 | P22748 | 1/20 | 0.67 |
| ▸ | CA6 | P23280 | 1/20 | 0.67 |
| ▸ | CA5A | P35218 | 1/20 | 0.67 |
| ▸ | CA7 | P43166 | 1/20 | 0.67 |
| ▸ | CA9 | Q16790 | 1/20 | 0.67 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.67 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.67 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | RARB | P10826 | 5/20 | 0.61 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| Paraben SCHEMBL8088142 | 1.00 | HSD17B3 (0.67) | HSD17B3CA12CA1CA2CA3 | |
| Hexadecane SCHEMBL379109 | 1.00 | HSD17B3 (0.67) | HSD17B3CA12CA1CA2CA3 | |
| Paraben SCHEMBL6321861 | 1.00 | HSD17B3 (0.67) | HSD17B3CA12CA1CA2CA3 | |
| Paraben SCHEMBL8861855 | 1.00 | HSD17B3 (0.67) | HSD17B3CA12CA1CA2CA3 | |
| Undecane SCHEMBL27536690 | 1.00 | HSD17B3 (0.67) | HSD17B3CA12CA1CA2CA3 | |
| Paraben SCHEMBL9770340 | 0.98 | CA12 (0.70) | HSD17B3CA12CA1CA2CA3 | |
| Myristyl Alcohol SCHEMBL5918231 | 0.93 | HSD17B3 (0.59) | HSD17B3CA12CA1CA2CA3 | |
| Cetyl Alcohol SCHEMBL10614956 | 0.93 | HSD17B3 (0.59) | HSD17B3CA12CA1CA2CA3 | |
| Dodecane SCHEMBL9354416 | 0.91 | TP53 (0.71) | TP53TSHRRARBPLA2G4BMEN1 | |
| Terephthalic Acid SCHEMBL28502502 | 0.91 | TP53 (0.71) | TP53TSHRRARBPLA2G4BMEN1 |
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-20110293868-A1 | THERMOPLASTIC POLYAMIDE MOULDING COMPOSITIONS | EMS-CHEMIE AG (CH) | 2011-12-01 | — | — | US | disclosed |
| US-20050250886-A1 | Thermoplastic polyamide moulding compositions | EMS-CHEMIE AG (CH) | 2005-11-10 | — | — | US | disclosed |