Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | HTR5A | P47898 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4484620 | 0.80 | HTR2A (0.41) | ARSIGMAR1HTR1AOPRK1ADRB2 | |
| SCHEMBL24879518 | 0.72 | HTR2C (0.56) | SIGMAR1HTR1AOPRK1ADRB2ADRA2A | |
| SCHEMBL14151107 | 0.69 | HTR2A (0.46) | ARSIGMAR1HTR1AHTR2CHTR2B | |
| SCHEMBL13736116 | 0.68 | TACR2 (0.46) | ARSIGMAR1HTR1AHTR2CHTR2B | |
| SCHEMBL22303469 | 0.67 | HTR2C (0.46) | SIGMAR1HTR1AOPRK1ADRB2ADRA2A | |
| SCHEMBL23987135 | 0.67 | HTR2C (0.46) | SIGMAR1HTR1AOPRK1ADRB2ADRA2A | |
| SCHEMBL606089 | 0.67 | HTR2A (0.56) | ARSIGMAR1HTR1ACYP19A1HTR2A | |
| SCHEMBL4564958 | 0.67 | HRH1 (0.50) | HTR1ASLC6A2HTR2CHRH1HTR2B | |
| SCHEMBL10348907 | 0.66 | SLC22A1 (0.63) | ADRB2BCHE | |
| SCHEMBL6826968 | 0.66 | HTR2A (0.50) | ARSIGMAR1HTR1ACYP19A1HTR2A |
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-2009039431-A2 | SUBSTITUTED ARYL-FUSED SPIROCYCLIC AMINES | NEUROGEN CORPORATION (US) | 2009-03-26 | — | — | WO | disclosed |