Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | NAAA | Q02083 | 3/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4347120 | 0.98 | NAAA (0.50) | ALDH1A1POLBMAPTNAAASIGMAR1 | |
| SCHEMBL10764905 | 0.86 | SIGMAR1 (0.48) | ALDH1A1POLBMAPTSIGMAR1HTR2A | |
| SCHEMBL7089776 | 0.81 | HRH1 (0.50) | ALDH1A1HTR2AMTORRAB9AGRM7 | |
| SCHEMBL3402186 | 0.81 | ALDH1A1 (0.72) | ALDH1A1POLBMAPTNAAASIGMAR1 | |
| SCHEMBL7111009 | 0.79 | CYP3A4 (0.61) | ALDH1A1POLBMAPTNAAASIGMAR1 | |
| Hydrochloric Acid SCHEMBL11127107 | 0.79 | ALDH1A1 (0.70) | ALDH1A1POLBMAPTNAAASIGMAR1 | |
| Water SCHEMBL11439219 | 0.79 | ALDH1A1 (0.70) | ALDH1A1POLBMAPTNAAASIGMAR1 | |
| SCHEMBL13512369 | 0.79 | CYP3A4 (0.61) | ALDH1A1POLBMAPTNAAASIGMAR1 | |
| SCHEMBL21799476 | 0.79 | HTR2A (0.47) | ALDH1A1POLBMAPTNAAASIGMAR1 | |
| SCHEMBL8118554 | 0.78 | SIGMAR1 (0.45) | SIGMAR1HTR2AMTORRAB9AGRM7 |
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-5679841-A | USING A HYDROPHOBIC SOLVENT PHASE AND AN AQUEOUS PHASE CONTAINING A STRONG ACID AND AN AUXILIARY AMINE; NEUTRALIZATION OF AQUEOUS PHASE | BAYER AKTIENGESELLSCHAFT (DE) | 1997-10-21 | — | — | US | disclosed |
| US-5648520-A | DISTILLATION, SOLVENT EXTRACTION | BAYER AKTIENGESELLSCHAFT (DE) | 1997-07-15 | — | — | US | disclosed |