Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | CAMK2A | Q9UQM7 | 6/20 | 0.45 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.44 |
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | FYN | P06241 | 1/20 | 0.44 |
| ▸ | GRB2 | P62993 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8460614 | 0.80 | PTGDR2 (0.41) | ALDH1A1LMNAGLAHPGDAKR1B1 | |
| SCHEMBL8464031 | 0.80 | KEAP1 (0.47) | ALDH1A1LMNACYP2C9HPGDAKR1B1 | |
| SCHEMBL8460626 | 0.80 | SRC (0.51) | ALDH1A1HPGDTSHRAKR1B1MEN1 | |
| SCHEMBL8464174 | 0.77 | PTGS1 (0.50) | LMNATSHRAKR1B1 | |
| SCHEMBL1644783 | 0.77 | EGFR (0.49) | EGFRALDH1A1LMNAGLACYP2C9 | |
| SCHEMBL155333 | 0.76 | EGFR (0.70) | EGFRALDH1A1LMNAGLACYP2C9 | |
| SCHEMBL30452045 | 0.76 | EGFR (0.70) | EGFRALDH1A1LMNAGLACYP2C9 | |
| SCHEMBL2535192 | 0.76 | EGFR (0.70) | EGFRALDH1A1LMNAGLACYP2C9 | |
| SCHEMBL29354171 | 0.76 | EGFR (0.70) | EGFRALDH1A1LMNAGLACYP2C9 | |
| SCHEMBL8463918 | 0.76 | HSD17B10 (0.64) | ALDH1A1LMNAHPGDLCKPOLB |
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 |