Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.35 |
| ▸ | CXCR4 | P61073 | 5/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TDP2 | O95551 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | FGB | P02675 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5574432 | 0.78 | CXCR4 (0.48) | SCN8ACXCR4MEN1KMT2ATLR7 | |
| SCHEMBL2083954 | 0.76 | CXCR4 (0.40) | CXCR4KDM4EALDH1A1HSP90AA1HSP90AB1 | |
| SCHEMBL5576980 | 0.76 | CXCR4 (0.46) | SCN8ACXCR4TLR7EGFR | |
| SCHEMBL6563481 | 0.70 | GABRA1 (0.47) | KDM4EALDH1A1MAPTHTTRAB9A | |
| SCHEMBL2085001 | 0.69 | CXCR4 (0.42) | SCN8ACXCR4TLR7KDM4ETSHR | |
| SCHEMBL2084791 | 0.68 | CACNA2D1 (0.34) | SCN8ACXCR4RAB9A | |
| SCHEMBL12812606 | 0.68 | KCNA5 (0.49) | SCN8AMEN1KMT2AALDH1A1GAA | |
| SCHEMBL23863915 | 0.66 | GABRA1 (0.42) | CXCR4ALDH1A1 | |
| SCHEMBL15131054 | 0.66 | SLC6A2 (0.65) | MEN1KMT2AKDM4EALDH1A1MAPT | |
| SCHEMBL2081855 | 0.65 | CXCR4 (0.47) | SCN8ACXCR4KDM4ETSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-7291631-B2 | CXCR4 chemokine receptor binding compounds | GENZYME CORPORATION (US) | 2007-11-06 | — | — | US | claimed |