Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 2/20 | 0.31 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7534006 | 0.71 | ALDH1A1 (0.46) | ALDH1A1TDP1KDM1AKDM1BMAPT | |
| SCHEMBL29001612 | 0.70 | ALDH1A1 (0.31) | ALDH1A1TDP1 | |
| SCHEMBL30402191 | 0.70 | ALDH1A1 (0.31) | ALDH1A1TDP1 | |
| SCHEMBL811929 | 0.68 | KDM1A (0.44) | ALDH1A1TDP1KDM1AKDM1BMAPT | |
| SCHEMBL29362089 | 0.68 | KDM1A (0.44) | ALDH1A1TDP1KDM1AKDM1BMAPT | |
| SCHEMBL18680691 | 0.68 | CA3 (0.39) | ALDH1A1TDP1KDM1AKDM1B | |
| SCHEMBL23351729 | 0.68 | KDM1A (0.48) | ALDH1A1TDP1KDM1AKDM1BMAPT | |
| SCHEMBL23010362 | 0.64 | — | — | |
| SCHEMBL20007610 | 0.63 | PDE2A (0.40) | — | |
| SCHEMBL7940907 | 0.63 | AHR (0.44) | ALDH1A1TDP1KDM1AKDM1BMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018072602-A1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2018-04-26 | — | — | WO | disclosed |