Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.52 |
| ▸ | CXCR4 | P61073 | 8/20 | 0.47 |
| ▸ | SLC40A1 | Q9NP59 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.37 |
| ▸ | TAOK3 | Q9H2K8 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3373812 | 0.86 | CXCR4 (0.56) | HDAC1HDAC6CXCR4SLC40A1LMNA | |
| SCHEMBL3999603 | 0.85 | CXCR4 (0.53) | HDAC1HDAC6CXCR4SLC40A1LMNA | |
| SCHEMBL14130832 | 0.84 | LMNA (0.57) | HDAC1HDAC6CXCR4LMNAKMT2A | |
| SCHEMBL4939126 | 0.80 | CXCR4 (0.48) | HDAC1HDAC6CXCR4SLC40A1LMNA | |
| SCHEMBL4108203 | 0.79 | CXCR4 (0.66) | HDAC1HDAC6CXCR4 | |
| SCHEMBL3993047 | 0.79 | CXCR4 (0.47) | HDAC1HDAC6CXCR4SLC40A1LMNA | |
| SCHEMBL31189930 | 0.78 | CXCR4 (0.47) | HDAC1HDAC6CXCR4LMNAKMT2A | |
| SCHEMBL31174254 | 0.78 | CXCR4 (0.47) | HDAC1HDAC6CXCR4LMNAKMT2A | |
| SCHEMBL3993862 | 0.78 | CXCR4 (0.49) | HDAC1HDAC6CXCR4SLC40A1LMNA | |
| SCHEMBL18661189 | 0.77 | CXCR4 (0.49) | HDAC1HDAC6CXCR4SLC40A1LMNA |
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-1465889-A4 | CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS WITH ENHANCED EFFICACY | ANORMED INC (CA) | 2008-05-14 | — | — | EP | disclosed |
| EP-1465889-A1 | CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS WITH ENHANCED EFFICACY | AnorMED Inc. (CA) | 2004-10-13 | — | — | EP | disclosed |
| WO-2003055876-A1 | CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS WITH ENHANCED EFFICACY | ANORMED INC. (CA) | 2003-07-10 | — | — | WO | disclosed |