Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR3 | P51677 | 1/20 | 0.33 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.31 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | BCHE | P06276 | 3/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6986361 | 0.99 | CCR3 (0.32) | CCR3CXCR4ACHEMAOBADRA1D | |
| Hydrochloric Acid SCHEMBL6984600 | 0.90 | TPSAB1 (0.33) | CXCR4ACHEMAOB | |
| SCHEMBL6983530 | 0.88 | SLC6A4 (0.34) | ACHEMAOBSLC6A4 | |
| Hydrochloric Acid SCHEMBL6980763 | 0.87 | SLC6A4 (0.33) | ACHEMAOBSLC6A4 | |
| SCHEMBL6975786 | 0.86 | POLB (0.40) | CCR3POLB | |
| SCHEMBL6983768 | 0.85 | ACHE (0.35) | ACHEMAOBSLC6A4BCHE | |
| Hydrochloric Acid SCHEMBL8311464 | 0.85 | ADRA1D (0.35) | CXCR4ACHEMAOBADRA1DADRA1A | |
| Hydrochloric Acid SCHEMBL6976629 | 0.84 | ACHE (0.35) | ACHEMAOBSLC6A4BCHE | |
| SCHEMBL6986388 | 0.83 | SLC6A4 (0.45) | ACHEMAOBSLC6A4BCHE | |
| SCHEMBL6976596 | 0.83 | KCNA3 (0.41) | — |
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-6172085-B1 | CENTRAL NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-01-09 | — | — | US | disclosed |