Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | SQOR | Q9Y6N5 | 2/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23310486 | 0.71 | HTR2C (0.38) | NPC1KDM4EMEN1KMT2AELANE | |
| SCHEMBL20999088 | 0.71 | PDE4B (0.39) | ALDH1A1PDE4BPDE4APDE4CPDE4D | |
| SCHEMBL19489752 | 0.69 | POLB (0.54) | ALDH1A1CYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL23114366 | 0.66 | PTAFR (0.33) | ELANE | |
| Methoxymethane SCHEMBL27842914 | 0.61 | ALDH1A1 (0.50) | ALDH1A1HSD17B10BACE1PDE4BCYP2A6 | |
| SCHEMBL24345237 | 0.60 | ALDH1A1 (0.43) | ALDH1A1HSD17B10CYP3A4NPC1RAB9A | |
| SCHEMBL3785577 | 0.59 | ALDH1A1 (0.50) | ALDH1A1HSD17B10PIN1BACE1CYP3A4 | |
| SCHEMBL24049723 | 0.59 | PGR (0.56) | ALDH1A1BACE1SQORPDE4BPDE4A | |
| SCHEMBL294721 | 0.59 | ALDH1A1 (0.58) | ALDH1A1NPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL13385087 | 0.59 | PDE4B (0.48) | ALDH1A1HSD17B10PDE4BPDE4APDE4C |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10224562-B2 | Method for producing polymer electrolyte molded article, polymer electrolyte material, polymer electrolyte membrane, and polymer electrolyte fuel cell | TORAY INDUSTRIES, INC. (JP) | 2019-03-05 | — | — | US | disclosed |