Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 6/20 | 0.62 |
| ▸ | HTR1A | P08908 | 5/20 | 0.62 |
| ▸ | DRD2 | P14416 | 4/20 | 0.62 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.62 |
| ▸ | HTR2C | P28335 | 2/20 | 0.62 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.62 |
| ▸ | HRH1 | P35367 | 2/20 | 0.62 |
| ▸ | HTR6 | P50406 | 2/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.62 |
| ▸ | DRD3 | P35462 | 2/20 | 0.62 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.62 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.62 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.62 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.62 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.62 |
| ▸ | DRD1 | P21728 | 1/20 | 0.62 |
| ▸ | DRD4 | P21917 | 1/20 | 0.62 |
| ▸ | ACHE | P22303 | 1/20 | 0.62 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.62 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL8714677 | 0.90 | HTR2A (0.62) | HTR2AHTR1ADRD2ADRA2AHTR2C | |
| SCHEMBL27513300 | 0.81 | HTR2A (0.69) | HTR2AHTR1ADRD2ADRA2AHTR2C | |
| SCHEMBL1545822 | 0.80 | HTR1A (0.72) | HTR2AHTR1ADRD2ADRA2AHTR2C | |
| Anisole SCHEMBL3645349 | 0.80 | DRD2 (0.63) | HTR2AHTR1ADRD2ADRA2AHTR2C | |
| SCHEMBL1544927 | 0.80 | HTR1A (0.80) | HTR2AHTR1ADRD2ADRA2AHTR2C | |
| SCHEMBL7963611 | 0.80 | HTR6 (0.74) | HTR2AHTR1ADRD2HTR2CADRA1A | |
| SCHEMBL8671507 | 0.80 | HTR2A (0.52) | HTR2AHTR1ADRD2ADRA2AHTR2C | |
| Hydrochloric Acid SCHEMBL1545292 | 0.80 | HTR1A (0.71) | HTR2AHTR1ADRD2ADRA2AHTR2C | |
| SCHEMBL8716361 | 0.80 | HTR1A (0.68) | HTR2AHTR1ADRD2ADRA2AHTR2C | |
| SCHEMBL7881728 | 0.79 | ABCB11 (0.76) | HTR2AHTR1ADRD2ADRA2AHTR2C |
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-5889035-A | 1-(Arylthioalkyl, arylaminoalkyl or arylmethylenealkyl)-3-(heteroaryl) pyrrolidines and related compounds useful as antipsychotics and analgesics | HOECHST MARION ROUSSEL, INC. (US) | 1999-03-30 | — | — | US | disclosed |