Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 4/20 | 0.77 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.77 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.77 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.77 |
| ▸ | HTR2C | P28335 | 6/20 | 0.57 |
| ▸ | HTR2B | P41595 | 5/20 | 0.57 |
| ▸ | HTR2A | P28223 | 1/20 | 0.57 |
| ▸ | ADCY6 | O43306 | 1/20 | 0.48 |
| ▸ | ADCY3 | O60266 | 1/20 | 0.48 |
| ▸ | ADCY9 | O60503 | 1/20 | 0.48 |
| ▸ | ADCY5 | O95622 | 1/20 | 0.48 |
| ▸ | ADCY8 | P40145 | 1/20 | 0.48 |
| ▸ | ADCY7 | P51828 | 1/20 | 0.48 |
| ▸ | ADCY2 | Q08462 | 1/20 | 0.48 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.48 |
| ▸ | ADCY4 | Q8NFM4 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 2/20 | 0.47 |
| ▸ | DRD1 | P21728 | 2/20 | 0.47 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4330301 | 0.87 | PNMT (1.00) | PNMTADRA2AADRA2BADRA2CDRD2 | |
| SCHEMBL15108869 | 0.87 | PNMT (0.85) | PNMTADRA2AADRA2BADRA2CDRD2 | |
| Hydrochloric Acid SCHEMBL3970090 | 0.85 | PNMT (0.96) | PNMTADRA2AADRA2BADRA2CDRD2 | |
| SCHEMBL20978055 | 0.84 | ADRA2A (0.57) | PNMTADRA2AADRA2BADRA2CHTR2C | |
| SCHEMBL31122821 | 0.83 | PNMT (0.58) | PNMTADRA2AADRA2BADRA2CHTR2C | |
| SCHEMBL18454733 | 0.83 | — | — | |
| SCHEMBL29618375 | 0.78 | PNMT (0.54) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL4525476 | 0.78 | PNMT (0.54) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL1706815 | 0.78 | PNMT (0.54) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL13193777 | 0.76 | PNMT (0.52) | PNMTADRA2AADRA2BADRA2CMAOB |
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-2009050248-A1 | SUBSTITUTED PIPERIDINO-DIHYDROTHIENOPYRIMIDINES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-04-23 | — | — | WO | disclosed |