Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 15/20 | 0.51 |
| ▸ | PRCP | P42785 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5633684 | 1.00 | CCR5 (0.51) | CCR5PRCPCYP2D6OPRM1OPRD1 | |
| SCHEMBL5633870 | 0.93 | CCR5 (0.60) | CCR5KCNH2 | |
| SCHEMBL5634122 | 0.92 | CCR5 (0.47) | CCR5PRCPCYP2D6OPRM1OPRD1 | |
| SCHEMBL5633685 | 0.91 | CCR5 (0.54) | CCR5KCNH2 | |
| SCHEMBL5634675 | 0.91 | CCR5 (0.46) | CCR5PRCPCYP2D6OPRM1OPRD1 | |
| SCHEMBL14514104 | 0.91 | CCR5 (0.46) | CCR5PRCPCYP2D6OPRM1OPRD1 | |
| SCHEMBL5633851 | 0.90 | CCR5 (0.52) | CCR5PRCPKCNH2 | |
| SCHEMBL5634441 | 0.89 | CCR5 (0.59) | CCR5PRCPKCNH2 | |
| SCHEMBL5634436 | 0.89 | CCR5 (0.59) | CCR5PRCPKCNH2 | |
| SCHEMBL14514107 | 0.88 | CCR5 (0.43) | CCR5PRCPCYP2D6OPRM1OPRD1 |
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-7217714-B1 | CCR5 modulators | AGOURON PHARMACEUTICALS, INC. (US) | 2007-05-15 | — | — | US | disclosed |