Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.47 |
| ▸ | CYP26A1 | O43174 | 6/20 | 0.46 |
| ▸ | ACP1 | P24666 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | TGM2 | P21980 | 1/20 | 0.41 |
| ▸ | PORCN | Q9H237 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6898202 | 0.78 | CYP17A1 (0.44) | KDM4ECYP17A1CYP26A1CYP19A1 | |
| SCHEMBL4569650 | 0.78 | CYP17A1 (0.50) | KDM4ECYP17A1CYP26A1CYP19A1 | |
| Hydrochloric Acid SCHEMBL28870357 | 0.77 | CYP17A1 (0.43) | KDM4ECYP17A1CYP26A1CYP19A1 | |
| Bromide SCHEMBL28405764 | 0.77 | CYP17A1 (0.43) | KDM4ECYP17A1CYP26A1CYP19A1 | |
| SCHEMBL4551670 | 0.76 | CYP17A1 (0.37) | KDM4ECYP17A1CYP26A1CYP19A1HTT | |
| SCHEMBL29215164 | 0.74 | KDM4E (0.41) | KDM4ECYP17A1CYP26A1ACP1 | |
| SCHEMBL27749679 | 0.71 | CYP17A1 (0.40) | KDM4ECYP17A1CYP26A1CYP19A1HTT | |
| SCHEMBL11035620 | 0.70 | KMT2A (0.47) | KDM4ECYP17A1CYP26A1CYP19A1 | |
| SCHEMBL28131809 | 0.70 | ALDH1A1 (0.45) | KDM4ECYP17A1CYP26A1CYP19A1HTT | |
| SCHEMBL9272047 | 0.69 | CYP26A1 (0.54) | KDM4ECYP17A1CYP26A1CYP19A1 |
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-0198325-B1 | SUBSTITUTED ANILINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1992-07-15 | — | — | EP | disclosed |