Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.56 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | CCR5 | P51681 | 1/20 | 0.49 |
| ▸ | HRH1 | P35367 | 6/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10287959 | 0.90 | CCR1 (0.54) | CCR1CHRM2CCR5HRH1ADRA1A | |
| SCHEMBL13620881 | 0.90 | CCR1 (0.71) | CCR1CHRM2CCR5HRH1ADRA1A | |
| SCHEMBL655180 | 0.90 | CCR1 (0.71) | CCR1CHRM2CCR5HRH1ADRA1A | |
| SCHEMBL655181 | 0.90 | CCR1 (0.71) | CCR1CHRM2CCR5HRH1ADRA1A | |
| SCHEMBL7206934 | 0.88 | CCR1 (0.64) | CCR1CHRM2CCR5DRD2 | |
| SCHEMBL7206932 | 0.88 | CCR1 (0.64) | CCR1CHRM2CCR5DRD2 | |
| SCHEMBL10287870 | 0.85 | CCR1 (0.66) | CCR1CHRM2CCR5HRH1ADRA1A | |
| SCHEMBL14420118 | 0.85 | CCR1 (0.53) | CCR1CHRM2CCR5HRH1ADRA1A | |
| SCHEMBL14579626 | 0.85 | CCR1 (0.53) | CCR1CHRM2CCR5HRH1ADRA1A | |
| SCHEMBL10287522 | 0.84 | CCR1 (0.55) | CCR1CHRM2CCR5HRH1ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| US-9663537-B2 | Chemokine receptor antagonists and methods of use | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2017-05-30 | — | — | US | disclosed |