Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 17/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL10800579 | 0.79 | ALDH1A1 (0.44) | ALDH1A1HPGDCYP11B1CYP11B2 | |
| SCHEMBL17672498 | 0.74 | CYP11B2 (0.46) | KDM1ACYP11B1CYP11B2 | |
| SCHEMBL26589953 | 0.73 | AURKA (0.49) | KDM1ACYP11B1CYP11B2 | |
| SCHEMBL30339997 | 0.72 | ALDH1A1 (0.56) | ALDH1A1HPGD | |
| SCHEMBL7511320 | 0.70 | RARB (0.48) | KDM1ACYP11B1CYP11B2 | |
| SCHEMBL26773595 | 0.70 | KDM4E (0.60) | KDM1ACYP11B1CYP11B2 | |
| SCHEMBL393075 | 0.70 | S1PR3 (0.51) | ALDH1A1HPGDCYP11B1CYP11B2 | |
| SCHEMBL8676486 | 0.70 | SYK (0.45) | CYP11B1CYP11B2 | |
| SCHEMBL20512862 | 0.69 | CYP11B2 (0.41) | KDM1ACYP11B1CYP11B2 | |
| SCHEMBL20512721 | 0.69 | KDM1A (0.68) | KDM1A |
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-0445274-A1 | LIQUID CRYSTALLINE MEDIUM. | MERCK PATENT GMBH (DE) | 1991-09-11 | — | — | EP | disclosed |