Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.48 |
| ▸ | CNR2 | P34972 | 8/20 | 0.48 |
| ▸ | CNR1 | P21554 | 7/20 | 0.48 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | AHR | P35869 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ABHD12 | Q8N2K0 | 1/20 | 0.41 |
| ▸ | IDH1 | O75874 | 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 | |
|---|---|---|---|---|
| SCHEMBL485894 | 0.98 | CXCR2 (0.48) | ALDH1A1MEN1KMT2ACXCR2CNR2 | |
| Formic Acid SCHEMBL27693239 | 0.94 | CXCR2 (0.47) | ALDH1A1MEN1KMT2ACXCR2CNR2 | |
| SCHEMBL485511 | 0.87 | CXCR2 (0.62) | ALDH1A1MEN1KMT2ACXCR2CNR2 | |
| SCHEMBL23460958 | 0.87 | CXCR2 (0.46) | ALDH1A1MEN1KMT2ACXCR2CNR2 | |
| SCHEMBL23460956 | 0.87 | CXCR2 (0.46) | ALDH1A1MEN1KMT2ACXCR2CNR2 | |
| SCHEMBL486231 | 0.86 | CXCR2 (0.52) | ALDH1A1MEN1KMT2ACXCR2CNR2 | |
| SCHEMBL485551 | 0.85 | ALDH1A1 (0.49) | ALDH1A1MEN1KMT2ACXCR2CNR2 | |
| SCHEMBL485699 | 0.85 | CXCR2 (0.62) | ALDH1A1MEN1KMT2ACXCR2CNR2 | |
| SCHEMBL485455 | 0.83 | CXCR2 (0.49) | ALDH1A1MEN1KMT2ACXCR2CNR2 | |
| Formic Acid SCHEMBL27693212 | 0.82 | CXCR2 (0.50) | ALDH1A1MEN1KMT2ACXCR2CNR2 |
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-1836158-B1 | FUSED BICYCLIC CARBOXAMIDE DERIVATIVES FOR USE AS CXCR2 INHIBITORS IN THE TREATMENT OF INFLAMMATION | SANOFI AVENTIS DEUTSCHLAND (DE) | 2012-02-01 | — | — | EP | claimed |