Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | CCR8 | P51685 | 9/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6205468 | 0.88 | SLC6A4 (0.42) | CYP2D6CCR8SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6204001 | 0.85 | SLC6A4 (0.39) | CYP2D6ATMCCR8KMT2ASLC6A2 | |
| SCHEMBL6204231 | 0.85 | CCR8 (0.51) | MAPTHPGDCCR8KMT2AHTT | |
| SCHEMBL6411940 | 0.83 | CCR8 (0.59) | CCR8 | |
| SCHEMBL6204695 | 0.82 | SLC6A2 (0.40) | CYP2D6KMT2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL6415241 | 0.82 | CCR8 (0.55) | MAPTCCR8KDM4E | |
| SCHEMBL6203108 | 0.82 | CCR8 (0.47) | CCR8POLB | |
| SCHEMBL6248463 | 0.81 | CCR8 (0.46) | MAPTHPGDCCR8KDM4E | |
| SCHEMBL6204086 | 0.81 | CCR8 (0.52) | CCR8 | |
| SCHEMBL6256044 | 0.79 | HTR2A (0.46) | SLC6A2SLC6A4SLC6A3KCNH2 |
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-1581511-A1 | CCR8 INHIBITORS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2005-10-05 | — | — | EP | disclosed |
| WO-2004058736-A1 | CCR8 INHIBITORS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2004-07-15 | — | — | WO | disclosed |