Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 5/20 | 0.84 |
| ▸ | HTR2B | P41595 | 2/20 | 0.84 |
| ▸ | PNMT | P11086 | 8/20 | 0.60 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.60 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.60 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.60 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8103831 | 0.90 | HTR2C (0.74) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| SCHEMBL4770064 | 0.90 | HTR2C (1.00) | HTR2CHTR2BUSP2GAAHTR2A | |
| SCHEMBL3879315 | 0.87 | HTR2C (0.66) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| SCHEMBL3876586 | 0.86 | HTR2C (0.85) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| SCHEMBL6613273 | 0.81 | HTR2C (0.59) | HTR2CHTR2BPNMTUSP2GAA | |
| SCHEMBL1885004 | 0.79 | PNMT (0.71) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| SCHEMBL1156335 | 0.78 | HTR2C (0.68) | HTR2CHTR2BUSP2GAAKDM4E | |
| SCHEMBL31130054 | 0.78 | HTR2C (0.68) | HTR2CHTR2BUSP2GAAKDM4E | |
| Hydrochloric Acid SCHEMBL1075383 | 0.77 | PNMT (0.69) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| SCHEMBL4792399 | 0.77 | HTR2C (1.00) | HTR2CHTR2BPNMTGAAHTR2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1144405-B1 | TRIAZOLE COMPOUNDS WITH DOPAMINE-D3-RECEPTOR AFFINITY | ABBOTT GMBH & CO KG (DE) | 2009-11-25 | — | — | EP | disclosed |
| US-6602867-B1 | Triazole compounds with dopamine-D3-receptor affinity | ABBOTT LABORATORIES | 2003-08-05 | — | — | US | disclosed |