Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.55 |
| ▸ | MAOA | P21397 | 1/20 | 0.55 |
| ▸ | HSD11B1 | P28845 | 15/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CCR2 | P41597 | 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 | |
|---|---|---|---|---|
| SCHEMBL19403661 | 1.00 | MAOB (0.55) | MAOBMAOAHSD11B1PTGS2MEN1 | |
| SCHEMBL19385713 | 1.00 | MAOB (0.55) | MAOBMAOAHSD11B1PTGS2MEN1 | |
| SCHEMBL20673438 | 1.00 | MAOB (0.55) | MAOBMAOAHSD11B1PTGS2MEN1 | |
| SCHEMBL19385711 | 1.00 | MAOB (0.55) | MAOBMAOAHSD11B1PTGS2MEN1 | |
| SCHEMBL301325 | 0.85 | MAOB (0.55) | MAOBMAOAHSD11B1 | |
| SCHEMBL23549987 | 0.84 | MAOB (0.53) | MAOBMAOAHSD11B1PTGS2MEN1 | |
| SCHEMBL23550048 | 0.84 | MAOB (0.53) | MAOBMAOAHSD11B1PTGS2MEN1 | |
| SCHEMBL2833213 | 0.84 | MAOB (0.56) | MAOBMAOAHSD11B1PTGS2MEN1 | |
| SCHEMBL18685298 | 0.76 | CCR2 (0.48) | MAOBMAOAHSD11B1PTGS2MEN1 | |
| SCHEMBL18685458 | 0.76 | CCR2 (0.48) | MAOBMAOAHSD11B1PTGS2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3433239-A1 | SMALL MOLECULE INHIBITOR OF THE NUCLEAR TRANSLOCATION OF ANDROGEN RECEPTOR FOR THE TREATMENT OF CASTRATION-RESISTANT PROSTATE CANCER | University of Pittsburgh- Of the Commonwealth System of Higher Education (US) | 2019-01-30 | — | — | EP | disclosed |
| WO-2017165822-A1 | SMALL MOLECULE INHIBITOR OF THE NUCLEAR TRANSLOCATION OF ANDROGEN RECEPTOR FOR THE TREATMENT OF CASTRATION-RESISTANT PROSTATE CANCER | UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2017-09-28 | — | — | WO | disclosed |