Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP24A1 | Q07973 | 6/20 | 0.43 |
| ▸ | CYP26A1 | O43174 | 5/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | CYP27A1 | Q02318 | 3/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.39 |
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9854995 | 0.89 | METAP1 (0.44) | ACHECYP19A1THRATHRB | |
| SCHEMBL9855381 | 0.79 | CYP26A1 (0.60) | CYP24A1CYP26A1CYP27A1CYP19A1DGAT1 | |
| SCHEMBL9855296 | 0.78 | CYP24A1 (0.63) | CYP24A1CYP26A1ACHECYP27A1CYP19A1 | |
| SCHEMBL14454770 | 0.75 | ITGB3 (0.53) | CYP24A1CYP26A1DGAT1ITGB3ITGA2B | |
| SCHEMBL31374633 | 0.75 | ALDH1A1 (0.52) | CYP24A1ACHECYP27A1CYP19A1DGAT1 | |
| SCHEMBL6644734 | 0.75 | ALDH1A1 (0.52) | CYP24A1ACHECYP27A1CYP19A1DGAT1 | |
| SCHEMBL12799028 | 0.75 | PPARD (0.43) | ACHE | |
| SCHEMBL3023059 | 0.72 | FFAR1 (0.51) | ACHE | |
| SCHEMBL4622270 | 0.71 | CYP24A1 (0.61) | CYP24A1CYP26A1ACHECYP27A1CYP19A1 | |
| SCHEMBL7302984 | 0.71 | CYP19A1 (0.60) | CYP24A1CYP26A1ACHECYP27A1CYP19A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4983628-A | ANTIASTHMATIC, ANTIALLERGIC, ANTIINFLAMMATORY AND CYTOPROTECTIVE AGENTS | MERCK FROSST CANADA, INC. (CA) | 1991-01-08 | — | — | US | disclosed |
| EP-0140684-B1 | LEUKOTRIENE ANTAGONISTS | MERCK FROSST CANADA INC. (CA) | 1990-07-11 | — | — | EP | disclosed |
| US-4683325-A | ANTIINFLAMMATORY AGENTS, ANTIALLERGENS | MERCK FROSST CANADA, INC. (CA) | 1987-07-28 | — | — | US | disclosed |
| EP-0140684-A2 | Leukotriene antagonists | MERCK FROSST CANADA INC. (CA) | 1985-05-08 | — | — | EP | disclosed |