Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.53 |
| ▸ | DRD2 | P14416 | 3/20 | 0.53 |
| ▸ | HTR1A | P08908 | 5/20 | 0.51 |
| ▸ | HTR7 | P34969 | 2/20 | 0.49 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10684565 | 0.80 | CYP2D6 (0.79) | CYP2D6KCNH2SIGMAR1DRD2HTR1A | |
| SCHEMBL658968 | 0.80 | CYP2D6 (0.79) | CYP2D6KCNH2SIGMAR1DRD2HTR1A | |
| SCHEMBL24209294 | 0.80 | CYP2D6 (0.40) | CYP2D6KCNH2SIGMAR1DRD2HTR1A | |
| SCHEMBL9484863 | 0.80 | KCNH2 (0.59) | CYP2D6KCNH2SIGMAR1DRD2HTR1A | |
| SCHEMBL13589511 | 0.80 | DRD2 (0.62) | CYP2D6KCNH2SIGMAR1DRD2HTR1A | |
| SCHEMBL22015280 | 0.79 | CYP2D6 (0.39) | CYP2D6KCNH2SIGMAR1DRD2HTR1A | |
| SCHEMBL27698520 | 0.78 | MEN1 (0.69) | CYP2D6KCNH2SIGMAR1DRD2HTR1A | |
| SCHEMBL5187793 | 0.77 | CYP2D6 (1.00) | CYP2D6KCNH2SIGMAR1DRD2HTR1A | |
| SCHEMBL24209206 | 0.76 | HSD17B10 (0.46) | KCNH2SIGMAR1DRD2HTR1AMEN1 | |
| SCHEMBL9041083 | 0.76 | KCNH2 (0.80) | CYP2D6KCNH2SIGMAR1DRD2HTR1A |
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-2020099886-A1 | LOX INHIBITORS | THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) | 2020-05-22 | — | — | WO | disclosed |