Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 6/20 | 0.37 |
| ▸ | CCR1 | P32246 | 3/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CCR3 | P51677 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | HRH2 | P25021 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL15478400 | 0.85 | CCR1 (0.37) | DRD2CCR1OPRM1CHRM2CCR5 | |
| SCHEMBL15478333 | 0.84 | DRD2 (0.40) | DRD2CCR1OPRM1OPRL1CCR3 | |
| SCHEMBL15478355 | 0.84 | CCR1 (0.38) | DRD2CCR1OPRM1OPRL1CCR3 | |
| SCHEMBL15478375 | 0.83 | CCR1 (0.50) | DRD2CCR1OPRM1CHRM2OPRL1 | |
| SCHEMBL15478359 | 0.83 | CCR1 (0.38) | DRD2CCR1OPRM1OPRL1CCR3 | |
| SCHEMBL15478401 | 0.81 | CCR1 (0.37) | DRD2CCR1OPRM1CHRM2OPRL1 | |
| SCHEMBL15478335 | 0.81 | DRD2 (0.34) | DRD2CCR1OPRM1OPRL1DRD4 | |
| SCHEMBL15478403 | 0.80 | DRD2 (0.36) | DRD2CCR1OPRM1OPRL1DRD4 | |
| SCHEMBL15478363 | 0.80 | CCR1 (0.34) | DRD2CCR1OPRM1CHRM2CCR5 | |
| SCHEMBL18895930 | 0.80 | CCR1 (0.43) | DRD2CCR1OPRM1OPRL1HRH1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8653096-B2 | Chemokine receptor antagonists and methods of use thereof | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2014-02-18 | — | — | US | disclosed |
| US-7271176-B2 | Chemokine receptor antagonists and methods of use thereof | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2007-09-18 | — | — | US | disclosed |