Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.45 |
| ▸ | AKT1 | P31749 | 2/20 | 0.45 |
| ▸ | GSK3B | P49841 | 2/20 | 0.45 |
| ▸ | NEK4 | P51957 | 2/20 | 0.45 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.45 |
| ▸ | PRKG2 | Q13237 | 2/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.45 |
| ▸ | PRKG1 | Q13976 | 2/20 | 0.45 |
| ▸ | PKN2 | Q16513 | 2/20 | 0.45 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.45 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.45 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.45 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.45 |
| ▸ | PRKCG | P05129 | 1/20 | 0.45 |
| ▸ | CDK1 | P06493 | 1/20 | 0.45 |
| ▸ | PIM1 | P11309 | 1/20 | 0.45 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL515734 | 0.84 | RECQL (0.61) | LMNAF11RECQLKCNQ3KCNQ2 | |
| SCHEMBL1574475 | 0.80 | CCR5 (0.46) | RPS6KA5AKT1GSK3BNEK4PRKCD | |
| SCHEMBL12499369 | 0.80 | LMNA (0.68) | LMNARECQLRENMC4R | |
| SCHEMBL1574176 | 0.78 | CCR5 (0.58) | RPS6KA5AKT1GSK3BNEK4PRKCD | |
| SCHEMBL1574502 | 0.76 | CCR5 (0.46) | F11RECQLTDP1 | |
| SCHEMBL115980 | 0.76 | ROCK1 (0.55) | RPS6KA5AKT1GSK3BNEK4PRKCD | |
| SCHEMBL4598191 | 0.76 | ROCK1 (0.55) | RPS6KA5AKT1GSK3BNEK4PRKCD | |
| SCHEMBL29541844 | 0.74 | KCNQ3 (0.54) | LMNARECQLKCNQ3KCNQ2TDP1 | |
| SCHEMBL29541750 | 0.74 | KCNQ3 (0.54) | LMNARECQLKCNQ3KCNQ2TDP1 | |
| SCHEMBL26993332 | 0.74 | CCR5 (0.36) | MAPK1LMNARECQLRENKCNQ3 |
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-1140085-B1 | AZABICYCLOALKANES AS CCR5 MODULATORS | PHIVCO UK LTD (GB) | 2011-04-13 | — | — | EP | disclosed |