Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 3/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | USP19 | O94966 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4125113 | 0.79 | HTR2C (0.39) | HTR2CHTR2AHTR2BUSP19DRD2 | |
| SCHEMBL9527372 | 0.75 | HTR2C (0.46) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL5915126 | 0.72 | DRD2 (0.51) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL1074633 | 0.69 | HTR2C (0.47) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL8017476 | 0.66 | HTR2C (0.41) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL8422421 | 0.64 | HTR2C (0.43) | HTR2CHTR2AHTR2BUSP19 | |
| SCHEMBL8055769 | 0.64 | HRH1 (0.56) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL4558285 | 0.63 | KDM4E (0.39) | HTR2CHTR2AHTR2B | |
| SCHEMBL8911446 | 0.63 | HTR2C (0.53) | HTR2CHTR2AHTR2BDRD2 | |
| SCHEMBL6159599 | 0.62 | HTR7 (0.58) | — |
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-1981894-A2 | TRIPODAL LIGANDS WITH THE COORDINATING MOTIFS K2-BH2 OR K3-BH3 RELEVANT FOR BIOMEDICAL APPLICATIONS OF ORGANOMETALLIC COMPLEXES | MALLINCKRODT, INC. (US) | 2008-10-22 | — | — | EP | disclosed |
| WO-2007073472-A2 | TRIPODAL LIGANDS WITH THE COORDINATING MOTIFS K2-BH2 OR K3-BH3 RELEVANT FOR BIOMEDICAL APPLICATIONS OF ORGANOMETALLIC COMPLEXES | MALLINCKRODT INC. (US) | 2007-06-28 | — | — | WO | disclosed |