Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 4/20 | 0.58 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.49 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.49 |
| ▸ | HTR2A | P28223 | 5/20 | 0.42 |
| ▸ | HTR2C | P28335 | 5/20 | 0.42 |
| ▸ | HTR2B | P41595 | 4/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | REN | P00797 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.37 |
| ▸ | HTR1D | P28221 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13607536 | 0.91 | KMO (0.61) | KMOCHRM2CHRM1CHRM3HTR2A | |
| SCHEMBL3779615 | 0.84 | KMO (0.42) | KMOCHRM2CHRM1CHRM3HTR2A | |
| SCHEMBL3777719 | 0.84 | HTR2A (0.44) | KMOCHRM2CHRM1CHRM3HTR2A | |
| SCHEMBL3086407 | 0.83 | KMO (0.44) | KMOCHRM2CHRM1CHRM3HTR2A | |
| SCHEMBL17504300 | 0.82 | KMO (0.55) | KMOCHRM2CHRM1CHRM3HTR2A | |
| SCHEMBL3074398 | 0.82 | KMO (0.43) | KMOCHRM2CHRM1CHRM3HTR2A | |
| SCHEMBL78430 | 0.82 | REN (0.50) | KMOCHRM2CHRM1CHRM3HTR2A | |
| SCHEMBL3780833 | 0.82 | KMO (0.40) | KMOCHRM2CHRM1CHRM3HTR2A | |
| SCHEMBL29354552 | 0.80 | CYP1A2 (0.54) | KMOCHRM2CHRM1MAPK1LMNA | |
| SCHEMBL17678149 | 0.79 | KMO (0.58) | KMOCHRM2CHRM1CHRM3HTR2A |
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-8129538-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-06 | — | — | US | disclosed |