Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 17/20 | 0.62 |
| ▸ | CYP11B2 | P19099 | 17/20 | 0.62 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.43 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2789150 | 0.86 | CYP11B1 (0.61) | CYP11B1CYP11B2 | |
| Hydrochloric Acid SCHEMBL8763109 | 0.85 | CYP11B1 (0.60) | CYP11B1CYP11B2 | |
| SCHEMBL2786255 | 0.82 | CYP11B1 (0.71) | CYP11B1CYP11B2 | |
| SCHEMBL7804285 | 0.81 | FNTA (0.50) | CYP11B1CYP11B2PTGDR2 | |
| Bromide SCHEMBL7927507 | 0.81 | CYP11B1 (0.69) | CYP11B1CYP11B2 | |
| Hydrochloric Acid SCHEMBL8481395 | 0.81 | CYP11B1 (0.69) | CYP11B1CYP11B2 | |
| Hydrochloric Acid SCHEMBL7748921 | 0.80 | FNTA (0.49) | CYP11B1CYP11B2PTGDR2 | |
| Hydrochloric Acid SCHEMBL7842775 | 0.80 | CYP11B1 (0.67) | CYP11B1CYP11B2 | |
| SCHEMBL17544540 | 0.79 | CYP11B1 (0.71) | CYP11B1CYP11B2GPBAR1 | |
| SCHEMBL7169286 | 0.79 | CYP11B1 (0.57) | CYP11B1CYP11B2GPBAR1 |
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-5652257-A | ANTICARCINOGENIC | MERCK & CO., INC. (US) | 1997-07-29 | — | — | US | disclosed |
| WO-1996010034-A2 | THIOL-FREE INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1996-04-04 | — | — | WO | disclosed |