Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPE | Q05469 | 4/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | ACE | P12821 | 6/20 | 0.34 |
| ▸ | MME | P08473 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL5638919 | 0.83 | ALDH1A1 (0.36) | F10ALDH1A1ACEMME | |
| SCHEMBL5638966 | 0.83 | ALDH1A1 (0.36) | F10ALDH1A1ACEMME | |
| SCHEMBL5639681 | 0.81 | HPGD (0.38) | HTTALDH1A1ACEMMEPOLB | |
| SCHEMBL5638642 | 0.80 | LIPE (0.36) | LIPEHTTF10ALDH1A1POLB | |
| SCHEMBL5638651 | 0.80 | LIPE (0.36) | LIPEHTTALDH1A1POLB | |
| SCHEMBL5637126 | 0.80 | SMN1; SMN2 (0.42) | HTTALDH1A1ACEMMEPOLB | |
| SCHEMBL5639951 | 0.79 | MEN1 (0.37) | F10ALDH1A1ACEMME | |
| SCHEMBL5638645 | 0.78 | F10 (0.36) | F10ALDH1A1ACEMMEPOLB | |
| SCHEMBL5639998 | 0.78 | NPY1R (0.40) | LIPEACEMME | |
| SCHEMBL5638525 | 0.77 | ALDH1A1 (0.64) | ALDH1A1ACEMMEPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1534681-A1 | SUBSTITUTED QUINOLINE CCR5 RECEPTOR ANTAGONISTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2005-06-01 | — | — | EP | disclosed |
| WO-2004002960-A1 | SUBSTITUTED QUINOLINE CCR5 RECEPTOR ANTAGONISTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2004-01-08 | — | — | WO | disclosed |