Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 9/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3835443 | 0.87 | BCHE (0.63) | CYP2D6KCNH2KDM4EBCHEMAPK1 | |
| SCHEMBL2911384 | 0.86 | CHRM2 (0.64) | CYP2D6KCNH2 | |
| SCHEMBL720798 | 0.85 | CYP2D6 (0.58) | CYP2D6KCNH2 | |
| SCHEMBL3200254 | 0.85 | CYP2D6 (0.67) | CYP2D6KCNH2POLB | |
| SCHEMBL14382693 | 0.84 | CYP2D6 (0.57) | CYP2D6KCNH2 | |
| SCHEMBL3022343 | 0.84 | CYP2D6 (0.58) | CYP2D6KCNH2KMT2AKDM4EALDH1A1 | |
| SCHEMBL7465484 | 0.83 | KDM4E (0.72) | CYP2D6KMT2AKDM4EALDH1A1GAA | |
| SCHEMBL10645373 | 0.83 | CHRM2 (0.68) | KMT2AKDM4EALDH1A1SIGMAR1BCHE | |
| SCHEMBL3025595 | 0.83 | CYP2D6 (0.74) | CYP2D6KCNH2 | |
| SCHEMBL5947165 | 0.83 | KMT2A (0.60) | CYP2D6KCNH2KMT2ABCHECYP1A2 |
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-4752621-A | Arylalkyl amines useful for lowering intraocular pressure | SYNTEX (U.S.A.) INC. (US) | 1988-06-21 | — | — | US | disclosed |
| US-4642378-A | Arylalkyl amines useful for lowering intraocular pressure | SYNTEX (U.S.A.) INC. (US) | 1987-02-10 | — | — | US | disclosed |