Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 3/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.31 |
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
| ▸ | GBA1 | P04062 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL114021 | 0.90 | CXCR3 (0.37) | CXCR3KCNH2FEN1ALOX5APHTR1A | |
| SCHEMBL113125 | 0.89 | CXCR3 (0.40) | CXCR3KCNH2FEN1ALOX5APHTR1A | |
| SCHEMBL114041 | 0.88 | CXCR3 (0.39) | CXCR3KCNH2FEN1HTR1A | |
| SCHEMBL114405 | 0.85 | CXCR3 (0.39) | CXCR3KCNH2HTR1A | |
| SCHEMBL113141 | 0.84 | CXCR3 (0.38) | CXCR3KCNH2FEN1ALOX5APHTR1A | |
| SCHEMBL114747 | 0.84 | CXCR3 (0.35) | CXCR3KCNH2FEN1HTR1A | |
| SCHEMBL115477 | 0.83 | CXCR3 (0.42) | CXCR3KCNH2FEN1HTR1A | |
| SCHEMBL112035 | 0.83 | CNR2 (0.42) | CXCR3KCNH2FEN1ALOX5AP | |
| SCHEMBL114469 | 0.83 | CXCR3 (0.36) | CXCR3KCNH2ACACB | |
| SCHEMBL114638 | 0.82 | CXCR3 (0.38) | CXCR3KCNH2 |
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-2424840-A1 | CXCR3 RECEPTOR ANTAGONISTS | Boehringer Ingelheim International GmbH (DE) | 2012-03-07 | — | — | EP | disclosed |
| WO-2010126811-A1 | CXCR3 RECEPTOR ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-11-04 | — | — | WO | disclosed |