Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | LATS1 | O95835 | 2/20 | 0.38 |
| ▸ | IKBKB | O14920 | 3/20 | 0.37 |
| ▸ | CHUK | O15111 | 1/20 | 0.37 |
| ▸ | IKBKG | Q9Y6K9 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CCNC | P24863 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 2/20 | 0.36 |
| ▸ | NQO1 | P15559 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6534342 | 0.85 | MEN1 (0.45) | CYP19A1CYP11B1CYP11B2KDM1AIKBKB | |
| SCHEMBL13220280 | 0.75 | CYP19A1 (0.48) | CYP19A1CYP11B1CYP11B2KDM1AIKBKB | |
| SCHEMBL786755 | 0.75 | LATS1 (0.51) | LATS1CDK2NPC1RAB9A | |
| SCHEMBL20574275 | 0.72 | LATS1 (0.56) | LATS1 | |
| SCHEMBL1102744 | 0.72 | NQO1 (0.50) | CYP19A1CYP11B1CYP11B2KDM1AIKBKB | |
| SCHEMBL14450973 | 0.71 | CYP19A1 (0.52) | CYP19A1CYP11B1CYP11B2KDM1AIKBKB | |
| SCHEMBL3134206 | 0.70 | CYP19A1 (0.50) | CYP19A1CYP11B1CYP11B2KDM1AIKBKB | |
| SCHEMBL3138278 | 0.70 | CYP19A1 (0.44) | CYP19A1CYP11B1CYP11B2KDM1AIKBKB | |
| SCHEMBL246231 | 0.69 | LATS1 (0.43) | LATS1CHUK | |
| SCHEMBL20574285 | 0.69 | LATS1 (0.59) | LATS1CYP3A4GSK3B |
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-1465900-A1 | RHO-KINASE INHIBITORS | Bayer HealthCare AG (DE) | 2004-10-13 | — | — | EP | disclosed |
| WO-2003059913-A1 | ROH-KINASE INHIBITORS | BAYER HEALTHCARE AG (DE) | 2003-07-24 | — | — | WO | disclosed |