Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.34 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL5218367 | 1.00 | MEN1 (0.36) | MEN1KMT2AKDM4ETSHRLMNA | |
| SCHEMBL5224505 | 0.78 | CTSD (0.34) | CYP3A4CTSDBACE1BACE2 | |
| SCHEMBL5224498 | 0.78 | CTSD (0.34) | CYP3A4CTSDBACE1BACE2 | |
| SCHEMBL5218781 | 0.76 | POLB (0.43) | KDM4ELMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL5218771 | 0.76 | POLB (0.43) | KDM4ELMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL5395194 | 0.76 | KDM4E (0.40) | MEN1KMT2AKDM4ETSHRLMNA | |
| SCHEMBL5221255 | 0.76 | USP2 (0.46) | KDM4ETSHRLMNACYP1A2CYP2D6 | |
| SCHEMBL5221262 | 0.76 | USP2 (0.46) | KDM4ETSHRLMNACYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL5220450 | 0.75 | KDM4E (0.39) | MEN1KMT2AKDM4ETSHRLMNA | |
| SCHEMBL5220548 | 0.75 | KDM4E (0.44) | MEN1KMT2AKDM4ETSHRLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1567488-B1 | HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE | GLAXO GROUP LTD (GB) | 2007-02-21 | — | — | EP | disclosed |