Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 16/20 | 0.56 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14635433 | 1.00 | CYP19A1 (0.56) | CYP19A1MAOBPKMTSHR | |
| SCHEMBL14635445 | 1.00 | CYP19A1 (0.56) | CYP19A1MAOBPKMTSHR | |
| SCHEMBL30576333 | 1.00 | CYP19A1 (0.56) | CYP19A1MAOBPKMTSHR | |
| SCHEMBL69674 | 0.81 | CYP19A1 (0.49) | CYP19A1MAOB | |
| SCHEMBL13871265 | 0.80 | MAOB (0.48) | CYP19A1MAOBPKMTSHR | |
| SCHEMBL31088174 | 0.77 | MAOB (0.46) | CYP19A1MAOB | |
| SCHEMBL15147097 | 0.77 | CYP19A1 (0.59) | CYP19A1MAOBPKMTSHR | |
| SCHEMBL768947 | 0.77 | CYP19A1 (0.59) | CYP19A1MAOBPKMTSHR | |
| SCHEMBL8493061 | 0.76 | CYP19A1 (0.49) | CYP19A1 | |
| SCHEMBL8496691 | 0.75 | CYP19A1 (0.50) | CYP19A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013010453-A1 | CHEMOKING RECEPTOR ANTAGONISTS | ABBOTT LABORATORIES (US) | 2013-01-24 | — | — | WO | disclosed |