Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | ADCY10 | Q96PN6 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA3 | P07451 | 2/20 | 0.37 |
| ▸ | CA4 | P22748 | 2/20 | 0.37 |
| ▸ | CA6 | P23280 | 2/20 | 0.37 |
| ▸ | CA5A | P35218 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL718945 | 0.84 | ALDH1A1 (0.53) | ALDH1A1HSD17B10CASP1CASP7TDP1 | |
| SCHEMBL8460627 | 0.82 | HSD17B10 (0.40) | ALDH1A1HSD17B10CASP1CASP7TDP1 | |
| SCHEMBL6252709 | 0.80 | ALDH1A1 (0.50) | ALDH1A1HSD17B10CASP1CASP7TDP1 | |
| SCHEMBL1044488 | 0.78 | HSD17B10 (0.52) | ALDH1A1HSD17B10CASP1CASP7TDP1 | |
| SCHEMBL8463657 | 0.76 | CYP2D6 (0.48) | ALDH1A1HSD17B10CASP1CASP7KDM4E | |
| SCHEMBL3499329 | 0.73 | HSD17B10 (0.44) | ALDH1A1HSD17B10CASP1CASP7TDP1 | |
| SCHEMBL5655672 | 0.73 | ALDH1A1 (0.44) | ALDH1A1HSD17B10CASP1CASP7TDP1 | |
| SCHEMBL8462610 | 0.73 | HSD17B10 (0.59) | ALDH1A1HSD17B10CYP3A4KDM4EHPGD | |
| SCHEMBL8460658 | 0.72 | CA1 (0.43) | ALDH1A1HSD17B10CASP1CASP7TDP1 | |
| SCHEMBL812678 | 0.71 | HSD17B10 (0.55) | ALDH1A1HSD17B10CASP1CASP7TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0745326-B1 | Stabilization of aqueous 3-isothiazolone solutions | ROHM & HAAS (US) | 1999-09-22 | — | — | EP | disclosed |
| US-5594017-A | WITH AN IODOSYL OR IODYL COMPOUND | ROHM AND HAAS COMPANY (US) | 1997-01-14 | — | — | US | disclosed |
| EP-0745326-A1 | Stabilization of aqueous 3-isothiazolone solutions | ROHM AND HAAS COMPANY (US) | 1996-12-04 | — | — | EP | disclosed |