Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 6/20 | 0.35 |
| ▸ | CASP7 | P55210 | 5/20 | 0.35 |
| ▸ | CASP9 | P55211 | 1/20 | 0.35 |
| ▸ | VCAM1 | P19320 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | CRHBP | P24387 | 1/20 | 0.34 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 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 | |
|---|---|---|---|---|
| SCHEMBL2769590 | 1.00 | CASP3 (0.35) | CASP3CASP7CASP9VCAM1ALDH1A1 | |
| SCHEMBL2768975 | 1.00 | CASP3 (0.35) | CASP3CASP7CASP9VCAM1ALDH1A1 | |
| SCHEMBL2768514 | 0.90 | VCAM1 (0.36) | CASP3CASP7CASP9VCAM1ALDH1A1 | |
| SCHEMBL2768872 | 0.90 | VCAM1 (0.36) | CASP3CASP7CASP9VCAM1ALDH1A1 | |
| SCHEMBL6137742 | 0.90 | VCAM1 (0.36) | CASP3CASP7CASP9VCAM1ALDH1A1 | |
| SCHEMBL6563969 | 0.83 | CASP3 (0.46) | CASP3CASP7CASP9ALDH1A1KMT2A | |
| SCHEMBL2767458 | 0.78 | HDAC8 (0.37) | CASP3CASP7CASP9HDAC8HDAC6 | |
| SCHEMBL2769019 | 0.78 | HDAC8 (0.37) | CASP3CASP7CASP9HDAC8HDAC6 | |
| SCHEMBL6138091 | 0.78 | HDAC8 (0.37) | CASP3CASP7CASP9HDAC8HDAC6 | |
| SCHEMBL6564147 | 0.76 | CASP3 (0.45) | CASP3CASP7CASP9ALDH1A1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1272175-A4 | IL-8 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-08-31 | — | — | EP | disclosed |
| EP-1272175-A2 | IL-8 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-01-08 | — | — | EP | disclosed |
| WO-2001072960-A2 | IL-8 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 2001-10-04 | — | — | WO | disclosed |