Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2380488 | 0.88 | HSD11B1 (0.44) | CYP3A4KMT2AMAPK1ALDH1A1MEN1 | |
| SCHEMBL29499587 | 0.86 | POLB (0.38) | CYP3A4KMT2AMAPK1ALDH1A1MEN1 | |
| SCHEMBL10073218 | 0.85 | CYP3A4 (0.49) | CYP3A4KMT2AMAPK1ALDH1A1MEN1 | |
| SCHEMBL3765038 | 0.82 | CYP2C9 (0.37) | CYP3A4KMT2AMAPK1ALDH1A1MEN1 | |
| SCHEMBL10073222 | 0.81 | CXCR2 (0.40) | ALDH1A1CXCR2HSD11B1CXCR1CA1 | |
| SCHEMBL28162652 | 0.80 | CXCR2 (0.36) | CYP3A4KMT2AMEN1HPGDPOLB | |
| SCHEMBL1505411 | 0.78 | ALDH1A1 (0.39) | ALDH1A1HPGDCXCR2HSD11B1CXCR1 | |
| SCHEMBL22219651 | 0.78 | PTGS1 (0.50) | CYP3A4KMT2AMAPK1ALDH1A1MEN1 | |
| SCHEMBL1252245 | 0.76 | CXCR2 (0.34) | CYP3A4CXCR2HSD11B1CXCR1MAPT | |
| SCHEMBL926505 | 0.76 | CA2 (0.41) | CXCR2HSD11B1CXCR1CA1CA2 |
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-1942890-A4 | CHEMOKINE RECEPTOR BINDING COMPOUNDS | GENZYME CORP (US) | 2009-08-26 | — | — | EP | disclosed |
| EP-1942890-A2 | CHEMOKINE RECEPTOR BINDING COMPOUNDS | ANORMED INC. (CA) | 2008-07-16 | — | — | EP | disclosed |
| WO-2006138350-A2 | CHEMOKINE RECEPTOR BINDING COMPOUNDS | ANORMED INC. (CA) | 2006-12-28 | — | — | WO | disclosed |