Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 14/20 | 0.80 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.52 |
| ▸ | CCR5 | P51681 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 3/20 | 0.37 |
| ▸ | HRH1 | P35367 | 3/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD5 | P21918 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL652012 | 0.91 | CCR1 (0.81) | CCR1CHRM2CCR5HTR2BHRH1 | |
| SCHEMBL4341062 | 0.91 | CCR1 (0.81) | CCR1CHRM2CCR5HTR2BHRH1 | |
| SCHEMBL4341064 | 0.91 | CCR1 (0.81) | CCR1CHRM2CCR5HTR2BHRH1 | |
| SCHEMBL18776061 | 0.91 | CCR1 (0.81) | CCR1CHRM2CCR5HTR2BHRH1 | |
| SCHEMBL652013 | 0.91 | CCR1 (0.81) | CCR1CHRM2CCR5HTR2BHRH1 | |
| SCHEMBL653494 | 0.89 | CCR1 (1.00) | CCR1CHRM2CCR5HRH1 | |
| SCHEMBL438487 | 0.89 | CCR1 (1.00) | CCR1CHRM2CCR5HRH1 | |
| SCHEMBL656424 | 0.89 | CCR1 (0.77) | CCR1CHRM2CCR5HRH1 | |
| SCHEMBL438265 | 0.89 | CCR1 (1.00) | CCR1CHRM2CCR5HRH1 | |
| SCHEMBL2197331 | 0.89 | CCR1 (0.77) | CCR1CHRM2CCR5HRH1 |
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 |