Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 5/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.31 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.31 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.30 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12121948 | 0.76 | CCR1 (0.68) | CCR1HRH1HRH3ADRA1DADRA1A | |
| SCHEMBL16312668 | 0.73 | CCR1 (0.39) | CCR1HRH1HRH3ADRA1DADRA1A | |
| SCHEMBL15478321 | 0.73 | CCR1 (0.43) | CCR1HRH1HRH3ADRA1DADRA1A | |
| SCHEMBL18633833 | 0.72 | CCR1 (0.42) | CCR1HRH1HRH3ADRA1DADRA1A | |
| SCHEMBL18633827 | 0.69 | CCR1 (0.39) | CCR1HRH1HRH3SIGMAR1KCNK2 | |
| SCHEMBL18633830 | 0.68 | CCR1 (0.37) | CCR1HRH1HRH3PSMB1PSMB5 | |
| SCHEMBL15478357 | 0.67 | CCR1 (0.63) | CCR1HRH1ADRA1DADRA1AADRA1B | |
| SCHEMBL13824458 | 0.67 | CCR1 (0.37) | CCR1HRH1HRH3 | |
| SCHEMBL16312649 | 0.66 | CCR1 (0.62) | CCR1HRH1ADRA1DADRA1AADRA1B | |
| SCHEMBL15478326 | 0.66 | CCR1 (0.58) | CCR1HRH1 |
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-2286811-A1 | Chemokine receptor antagonists and methods of use thereof | Millennium Pharmaceuticals, Inc. (US) | 2011-02-23 | — | — | EP | disclosed |