Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 4/20 | 0.47 |
| ▸ | BCHE | P06276 | 3/20 | 0.47 |
| ▸ | BACE1 | P56817 | 3/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.45 |
| ▸ | DRD1 | P21728 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | DRD5 | P21918 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3054852 | 0.80 | CA9 (0.62) | ESR1ESR2LTA4HDRD2DRD1 | |
| SCHEMBL30658416 | 0.79 | MBTD1 (0.53) | KMT2ACXCR3ACHEDRD2DRD4 | |
| SCHEMBL27227657 | 0.79 | MBTD1 (0.53) | KMT2ACXCR3ACHEDRD2DRD4 | |
| SCHEMBL6424174 | 0.79 | CXCR3 (0.62) | CXCR3ACHEOPRM1DRD2DRD4 | |
| SCHEMBL7838809 | 0.77 | DRD2 (0.60) | ACHEDRD2DRD1DRD4DRD5 | |
| SCHEMBL28873244 | 0.77 | DRD2 (0.54) | ESR1ESR2DRD2DRD1DRD4 | |
| SCHEMBL3655702 | 0.76 | ACHE (0.53) | ACHEBCHEBACE1ESR1ESR2 | |
| SCHEMBL3655701 | 0.76 | ACHE (0.53) | ACHEBCHEBACE1ESR1ESR2 | |
| SCHEMBL23258818 | 0.74 | PNMT (0.57) | ESR1ESR2LTA4HDRD2DRD1 | |
| SCHEMBL23553675 | 0.74 | SLC18A3 (0.56) | ACHEBCHEBACE1 |
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-2200998-A1 | AZACYCLYLISOQUINOLINONE AND ISOINDOLINONE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS | Wyeth a Corporation of the State of Delaware (US) | 2010-06-30 | — | — | EP | disclosed |
| WO-2009036117-A1 | AZACYCLYLISOQUINOLINONE AND ISOINDOLINONE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS | WYETH (US) | 2009-03-19 | — | — | WO | disclosed |