Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 15/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.59 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2401015 | 0.91 | CCR1 (0.67) | CCR1NPSR1HSP90AA1MAPTKDM4E | |
| SCHEMBL5682771 | 0.90 | CCR1 (0.66) | CCR1NPSR1HSP90AA1MAPTKDM4E | |
| SCHEMBL1420218 | 0.88 | CCR1 (0.52) | CCR1NPSR1HSP90AA1MAPTKDM4E | |
| SCHEMBL12264505 | 0.88 | CCR1 (0.52) | CCR1NPSR1HSP90AA1MAPTKDM4E | |
| SCHEMBL1420119 | 0.86 | CCR1 (0.64) | CCR1NPSR1HSP90AA1MAPTKDM4E | |
| SCHEMBL1419710 | 0.86 | CCR1 (0.63) | CCR1NPSR1HSP90AA1MAPTKDM4E | |
| SCHEMBL2401851 | 0.85 | CCR1 (0.59) | CCR1NPSR1HSP90AA1MAPTALDH1A1 | |
| SCHEMBL1420113 | 0.85 | CCR1 (0.62) | CCR1NPSR1HSP90AA1MAPTKDM4E | |
| SCHEMBL2399482 | 0.85 | CCR1 (0.69) | CCR1NPSR1HSP90AA1MAPTALDH1A1 | |
| SCHEMBL2399579 | 0.84 | CCR1 (0.61) | CCR1NPSR1HSP90AA1MAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009137338-A1 | PYRAZOLE COMPOUNDS AS CCR1 ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-11-12 | — | — | WO | disclosed |