Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 16/20 | 1.00 |
| ▸ | HTR2B | P41595 | 13/20 | 1.00 |
| ▸ | PNMT | P11086 | 3/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.51 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.51 |
| ▸ | MLNR | O43193 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1077845 | 0.90 | HTR2C (0.82) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| Hydrochloric Acid SCHEMBL11738740 | 0.89 | HTR2C (0.80) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| SCHEMBL4030704 | 0.81 | PNMT (0.81) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| SCHEMBL28162945 | 0.79 | HTR2C (0.66) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| Hydrochloric Acid SCHEMBL10350527 | 0.79 | PNMT (0.78) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| SCHEMBL8178590 | 0.79 | HTR2C (0.65) | HTR2CHTR2BPNMT | |
| SCHEMBL994897 | 0.79 | HTR2C (0.65) | HTR2CHTR2B | |
| SCHEMBL4767812 | 0.78 | HTR2C (0.64) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| SCHEMBL6955385 | 0.77 | PNMT (0.81) | HTR2CHTR2BPNMTADRA2AADRA2B | |
| SCHEMBL10623977 | 0.77 | PNMT (0.73) | HTR2CHTR2BPNMTADRA2AADRA2B |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9035059-B2 | Nitrogen-containing condensed heterocyclic compound | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2015-05-19 | — | — | US | disclosed |
| US-7429579-B2 | Tetrahydrobenzazepine derivatives useful as modulators of dopamine D3 receptors (antipsychotic agents) | SMITHKLINE BEECHAM, PLC (GB) | 2008-09-30 | — | — | US | disclosed |
| EP-1335915-B1 | TETRAHYDROBENZAZEPINE DERIVATIVES USEFUL AS MODULATORS OF DOPAMINE D3 RECEPTORS (ANTIPSYCHOTIC AGENTS) | SMITHKLINE BEECHAM PLC (GB) | 2008-01-02 | — | — | EP | disclosed |
| EP-1335915-A2 | TETRAHYDROBENZAZEPINE DERIVATIVES USEFUL AS MODULATORS OF DOPAMINE D3 RECEPTORS (ANTIPSYCHOTIC AGENTS) | SMITHKLINE BEECHAM PLC (GB) | 2003-08-20 | — | — | EP | disclosed |
| WO-2002040471-A2 | TETRAHYDROBENZAZEPINE DERIVATIVES USEFUL AS MODULATORS OF DOPAMINE D3 RECEPTORS (ANTIPSYCHOTIC AGENTS) | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-05-23 | — | — | WO | disclosed |