Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.32 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | GABRP | O00591 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5497718 | 0.87 | PNMT (0.53) | PNMTNPC1RAB9AALDH1A1GAA | |
| SCHEMBL5497721 | 0.83 | PNMT (0.48) | PNMTNPC1RAB9AALDH1A1GAA | |
| SCHEMBL7565254 | 0.81 | KMT2A (0.40) | PNMTNPC1RAB9AALDH1A1HTR7 | |
| SCHEMBL5499370 | 0.79 | PNMT (0.42) | PNMTNPC1RAB9AALDH1A1GAA | |
| SCHEMBL4839271 | 0.79 | PNMT (0.51) | PNMTNPC1RAB9AALDH1A1GAA | |
| SCHEMBL4059189 | 0.78 | PNMT (0.54) | PNMTNPC1RAB9AALDH1A1GAA | |
| SCHEMBL27429983 | 0.78 | PNMT (0.52) | PNMTNPC1RAB9AALDH1A1GAA | |
| SCHEMBL6849876 | 0.78 | PNMT (0.50) | PNMTNPC1RAB9AALDH1A1GAA | |
| SCHEMBL19384366 | 0.77 | RAB9A (0.50) | PNMTNPC1RAB9AALDH1A1GAA | |
| SCHEMBL8474155 | 0.76 | PNMT (0.51) | PNMTNPC1RAB9AALDH1A1GAA |
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-1225918-A2 | CONJUGATES USEFUL IN THE TREATMENT OF PROSTATE CANCER | Merck & Co., Inc. (US) | 2002-07-31 | — | — | EP | disclosed |
| WO-2001028593-A2 | CONJUGATES USEFUL IN THE TREATMENT OF PROSTATE CANCER | MERCK & CO., INC. (US) | 2001-04-26 | — | — | WO | disclosed |