Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 15/20 | 0.55 |
| ▸ | CYP11B2 | P19099 | 15/20 | 0.55 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.55 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL25556119 | 0.90 | CYP11B1 (0.46) | CYP11B1CYP11B2CYP19A1CYP1A2CYP17A1 | |
| SCHEMBL19495406 | 0.86 | CYP11B1 (0.58) | CYP11B1CYP11B2CYP19A1CYP1A2CYP17A1 | |
| SCHEMBL12045381 | 0.84 | ACVRL1 (0.43) | CYP11B1CYP11B2CYP19A1CYP1A2CYP17A1 | |
| SCHEMBL13019295 | 0.78 | SMN1; SMN2 (0.40) | CYP11B1CYP11B2CYP19A1CYP1A2CYP17A1 | |
| Hydrochloric Acid SCHEMBL5312798 | 0.77 | CYP11B1 (0.38) | CYP11B1CYP11B2CYP19A1CYP1A2CYP17A1 | |
| SCHEMBL25017649 | 0.76 | CYP11B2 (0.49) | CYP11B1CYP11B2CYP19A1CYP1A2CYP17A1 | |
| SCHEMBL25551278 | 0.76 | HDAC6 (0.44) | CYP11B1CYP11B2CYP19A1CYP1A2CYP17A1 | |
| SCHEMBL13125709 | 0.75 | SIGMAR1 (0.40) | CYP11B1CYP11B2CYP19A1CYP1A2CYP17A1 | |
| SCHEMBL14780230 | 0.74 | CYP11B1 (0.70) | CYP11B1CYP11B2CYP19A1CYP1A2CYP17A1 | |
| SCHEMBL761220 | 0.73 | SRD5A1 (0.54) | CYP11B1CYP11B2CYP19A1CYP1A2CYP17A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2393806-B1 | INHIBITORS OF JUN N-TERMINAL KINASE | ELAN PHARM INC (US) | 2017-10-25 | — | — | EP | disclosed |