Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.49 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HTR7 | P34969 | 2/20 | 0.43 |
| ▸ | HTR6 | P50406 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8716548 | 0.94 | HSD11B1 (0.54) | HTR2AHSD11B1ACHEHTR2CHTR7 | |
| SCHEMBL9232680 | 0.90 | HSD11B1 (0.56) | HTR2AHSD11B1ACHEHTR2CHTR7 | |
| SCHEMBL8714509 | 0.89 | HSD11B1 (0.51) | HTR2AHSD11B1ACHEHTR2CHTR7 | |
| SCHEMBL8711227 | 0.88 | HTR2A (0.46) | HTR2AHSD11B1ACHEHTR2CHTR7 | |
| SCHEMBL8711102 | 0.88 | HSD11B1 (0.51) | HTR2AHSD11B1ACHEHTR2CHTR7 | |
| SCHEMBL8715718 | 0.87 | HTR2A (0.61) | HTR2AHSD11B1ACHEKDM4ECYP1A2 | |
| SCHEMBL8716772 | 0.87 | HSD11B1 (0.51) | HTR2AHSD11B1ACHEHTR2CHTR7 | |
| SCHEMBL8712117 | 0.86 | HSD11B1 (0.59) | HTR2AHSD11B1ACHEHTR2CHTR7 | |
| SCHEMBL8711229 | 0.86 | ACHE (0.50) | HTR2AHSD11B1ACHEHTR2CHTR7 | |
| SCHEMBL8710854 | 0.85 | MEN1 (0.47) | HTR2AHSD11B1ACHEHTR2CHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| US-5728835-A | HYPOTENSIVE AGENTS; ANTIISCHEMIC AGENTS | TOA EIYO, LTD. (JP) | 1998-03-17 | — | — | US | disclosed |
| EP-0661266-A1 | Substituted cyclic amine compounds as 5HT2 antagonists | TOA EIYO LTD. (JP) | 1995-07-05 | — | — | EP | disclosed |