Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | REN | P00797 | 17/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 17/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7002582 | 0.82 | SLC6A3 (0.48) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7001284 | 0.81 | LMNA (0.44) | DRD2SLC6A3 | |
| SCHEMBL6995034 | 0.81 | SLC6A3 (0.38) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7002089 | 0.79 | SLC6A2 (0.39) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7005083 | 0.79 | SLC6A4 (0.41) | RENSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7001987 | 0.78 | KMT2A (0.43) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7001738 | 0.76 | ALDH1A1 (0.36) | SLC6A3 | |
| SCHEMBL7003952 | 0.71 | SLC6A4 (0.51) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6995928 | 0.68 | SLC6A3 (0.42) | KCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL14508411 | 0.66 | HSD11B1 (0.46) | CES2CES1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1242080-A4 | DOPAMINE TRANSPORTER INHIBITORS AND THEIR USE | UNIV GEORGETOWN (US) | 2003-01-22 | — | — | EP | claimed |
| EP-1242080-A1 | DOPAMINE TRANSPORTER INHIBITORS AND THEIR USE | GEORGETOWN UNIVERSITY (US) | 2002-09-25 | — | — | EP | claimed |
| WO-2001022964-A1 | DOPAMINE TRANSPORTER INHIBITORS AND THEIR USE | GEORGETOWN UNIVERSITY (US) | 2001-04-05 | — | — | WO | claimed |
| EP-1242080-A4 | DOPAMINE TRANSPORTER INHIBITORS AND THEIR USE | UNIV GEORGETOWN (US) | 2003-01-22 | — | — | EP | disclosed |
| EP-1242080-A1 | DOPAMINE TRANSPORTER INHIBITORS AND THEIR USE | GEORGETOWN UNIVERSITY (US) | 2002-09-25 | — | — | EP | disclosed |
| WO-2001022964-A1 | DOPAMINE TRANSPORTER INHIBITORS AND THEIR USE | GEORGETOWN UNIVERSITY (US) | 2001-04-05 | — | — | WO | disclosed |