Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.36 |
| ▸ | CASP6 | P55212 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | NT5E | P21589 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4904953 | 0.86 | ALDH1A1 (0.47) | ALDH1A1HSD17B10LMNATSHRPRMT1 | |
| SCHEMBL7048887 | 0.76 | PTPN1 (0.45) | ALDH1A1HSD17B10TP53MAPTTSHR | |
| SCHEMBL6184269 | 0.75 | MPL (0.39) | HSD17B10LMNACASP6CYP2D6NT5E | |
| SCHEMBL6631900 | 0.73 | ALDH1A1 (0.47) | ALDH1A1HSD17B10LMNAMAPTTSHR | |
| SCHEMBL1376900 | 0.71 | NPC1 (0.39) | ALDH1A1HSD17B10NPC1LMNATP53 | |
| SCHEMBL760004 | 0.71 | CYP2D6 (0.39) | ALDH1A1HSD17B10MAPTTSHRMAPK1 | |
| SCHEMBL9340369 | 0.71 | HSD17B10 (0.49) | ALDH1A1HSD17B10NPC1LMNATP53 | |
| SCHEMBL6180539 | 0.71 | SLC2A1 (0.41) | CYP1A2 | |
| SCHEMBL6631398 | 0.70 | ALDH1A1 (0.47) | ALDH1A1HSD17B10LMNATSHRPRMT1 | |
| SCHEMBL5465505 | 0.69 | CYP2D6 (0.38) | ALDH1A1HSD17B10MAPTTSHRMAPK1 |
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-0133283-B1 | WATER-SOLUBLE DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS DYESTUFFS | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-04-01 | — | — | EP | claimed |
| US-5138041-A | Water-soluble fiber-reactive monoazo and disazo dyestuffs having a s-triazinylamino group and three fiber-reactive groups of the vinylsulfone series | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-08-11 | — | — | US | disclosed |
| US-4806127-A | FIBER-REACTIVE DYES | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-02-21 | — | — | US | disclosed |