Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 1/20 | 0.39 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.38 |
| ▸ | REN | P00797 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.35 |
| ▸ | PLG | P00747 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4125875 | 0.99 | CXCR4 (0.39) | CXCR4DPP7RENHRH3CHRM4 | |
| Hydrochloric Acid SCHEMBL4116331 | 0.99 | CXCR4 (0.39) | CXCR4DPP7RENHRH3CHRM4 | |
| SCHEMBL2014147 | 0.90 | CXCR4 (0.37) | CXCR4AVPR1BALKOPRK1 | |
| SCHEMBL4104403 | 0.90 | CXCR4 (0.37) | CXCR4AVPR1BALKOPRK1 | |
| SCHEMBL13696579 | 0.90 | CXCR4 (0.37) | CXCR4AVPR1BALKOPRK1 | |
| Hydrochloric Acid SCHEMBL4110811 | 0.89 | CXCR4 (0.41) | CXCR4HRH3LNPEPALKIDH1 | |
| Hydrochloric Acid SCHEMBL4116497 | 0.89 | CXCR4 (0.41) | CXCR4HRH3LNPEPALKIDH1 | |
| Hydrochloric Acid SCHEMBL4124504 | 0.88 | CXCR4 (0.42) | CXCR4ALKIDH1 | |
| Hydrochloric Acid SCHEMBL4104281 | 0.88 | CXCR4 (0.42) | CXCR4ALKIDH1 | |
| SCHEMBL4110044 | 0.84 | CXCR4 (0.40) | CXCR4ALK |
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 |
|---|---|---|---|---|---|---|---|
| EP-1852432-A1 | NITROGENOUS HETEROCYCLIC COMPOUND AND MEDICINAL USE THEREOF | ONO PHARMACEUTICAL CO., LTD. (JP) | 2007-11-07 | — | — | EP | disclosed |