Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | HTR2B | P41595 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8703784 | 0.89 | HTR2C (0.40) | HTR2CHTR2BCYP1A2ADRA2AMAOA | |
| SCHEMBL8703648 | 0.81 | CA1 (0.31) | — | |
| SCHEMBL12355697 | 0.77 | FYN (0.50) | HTR2CHTR2BCYP1A2ADRA2AMAOA | |
| SCHEMBL8700156 | 0.75 | IDO1 (0.44) | HTR2BADRA2ASLC6A4HTR2A | |
| SCHEMBL12355679 | 0.74 | CYP1A2 (0.50) | HTR2CHTR2BCYP1A2ADRA2AMAOA | |
| SCHEMBL8700889 | 0.74 | PNMT (0.44) | ADRA2A | |
| SCHEMBL2246016 | 0.72 | CYP1A2 (0.44) | HTR2CHTR2BCYP1A2ADRA2AMAOA | |
| SCHEMBL5582685 | 0.71 | MCHR1 (0.54) | HTR2CHTR2BCYP1A2ADRA2AMAOA | |
| SCHEMBL2250545 | 0.70 | CYP1A2 (0.46) | HTR2CHTR2BCYP1A2ADRA2AMAOA | |
| SCHEMBL2246315 | 0.69 | CYP1A2 (0.54) | HTR2CHTR2BCYP1A2ADRA2AMAOA |
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-1998005651-A1 | NOVEL GLUTAMATE RECEPTOR ANTAGONISTS: FUSED CYCLOALKYL QUINOXALINEDIONES | WARNER-LAMBERT COMPANY (US) | 1998-02-12 | — | — | WO | disclosed |