Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.32 |
| ▸ | KLK1 | P06870 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL4033759 | 0.79 | CXCR4 (0.39) | CXCR4MEN1KMT2ANPSR1KLKB1 | |
| SCHEMBL4030012 | 0.78 | CXCR4 (0.35) | CXCR4SMN1; SMN2 | |
| SCHEMBL2083085 | 0.76 | CXCR4 (0.32) | CXCR4MEN1HTTKMT2AKLKB1 | |
| SCHEMBL4030668 | 0.74 | CXCR4 (0.34) | CXCR4MEN1KMT2ANPSR1KLKB1 | |
| SCHEMBL4032125 | 0.68 | CXCR4 (0.38) | CXCR4MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL2085695 | 0.67 | CXCR4 (0.31) | CXCR4 | |
| SCHEMBL2084557 | 0.63 | CXCR4 (0.58) | CXCR4LMNAKMT2ASMN1; SMN2 | |
| SCHEMBL2084559 | 0.63 | CXCR4 (0.58) | CXCR4LMNAKMT2ASMN1; SMN2 | |
| SCHEMBL12935085 | 0.63 | CXCR4 (0.47) | CXCR4 | |
| SCHEMBL2085045 | 0.62 | CXCR4 (0.38) | CXCR4MEN1KMT2A |
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-1613613-A4 | CXCR4 CHEMOKINE RECEPTOR BINDING COMPOUNDS | ANORMED INC (CA) | 2009-03-25 | — | — | EP | disclosed |
| EP-1613613-A2 | CXCR4 CHEMOKINE RECEPTOR BINDING COMPOUNDS | ANORMED INC. (CA) | 2006-01-11 | — | — | EP | disclosed |
| WO-2004091518-A2 | CXCR4 CHEMOKINE RECEPTOR BINDING COMPOUNDS | ANORMED INC. (CA) | 2004-10-28 | — | — | WO | disclosed |