Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 4/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | METAP2 | P50579 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.47 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.42 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23476 | 0.79 | ALDH1A1 (0.59) | ALDH1A1KDM4EHPGDMAPTTSHR | |
| SCHEMBL29517020 | 0.79 | ALDH1A1 (0.59) | ALDH1A1KDM4EHPGDMAPTTSHR | |
| SCHEMBL1092311 | 0.78 | NPC1 (0.37) | ALDH1A1KDM4EHPGDMAPTTSHR | |
| Ammonia Solution, Strong SCHEMBL29433157 | 0.77 | ALDH1A1 (0.56) | ALDH1A1KDM4EHPGDMAPTTSHR | |
| SCHEMBL39118 | 0.77 | ALDH1A1 (0.70) | ALDH1A1KDM4EHPGDMAPTTSHR | |
| SCHEMBL4967588 | 0.77 | ALDH1A1 (0.70) | ALDH1A1KDM4EHPGDMAPTTSHR | |
| SCHEMBL8612213 | 0.76 | ALDH1A1 (0.54) | ALDH1A1KDM4EHPGDMAPTTSHR | |
| Potassium Ion SCHEMBL8613656 | 0.76 | ALDH1A1 (0.48) | ALDH1A1KDM4EHPGDMAPTTSHR | |
| Potassium SCHEMBL317509 | 0.75 | ALDH1A1 (0.67) | ALDH1A1KDM4EHPGDMAPTTSHR | |
| SCHEMBL1158413 | 0.75 | ALDH1A1 (0.67) | ALDH1A1KDM4EHPGDMAPTTSHR |
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 |