Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.36 |
| ▸ | HTR7 | P34969 | 3/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | SOS1 | Q07889 | 3/20 | 0.35 |
| ▸ | HTR2A | P28223 | 4/20 | 0.34 |
| ▸ | DRD3 | P35462 | 4/20 | 0.34 |
| ▸ | MAOB | P27338 | 3/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | LTA4H | P09960 | 2/20 | 0.33 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4405864 | 0.94 | SOS1 (0.38) | HTR1AHTR7CCR5SOS1HTR2A | |
| Hydrochloric Acid SCHEMBL4401842 | 0.91 | MCHR1 (0.36) | HTR1AHTR7SOS1DRD3DRD2 | |
| SCHEMBL4396592 | 0.91 | CCR5 (0.34) | HTR1AHTR7CCR5HTR2ADRD3 | |
| SCHEMBL4405632 | 0.91 | MAOB (0.38) | HTR2ADRD3MAOBDRD2MAOA | |
| SCHEMBL4401840 | 0.90 | MAOB (0.44) | HTR1ADRD3MAOBDRD2LTA4H | |
| Hydrochloric Acid SCHEMBL4396448 | 0.90 | SOS1 (0.33) | HTR1AHTR7CCR5SOS1MAOB | |
| SCHEMBL4398599 | 0.89 | ALDH1A1 (0.34) | HTR1ASOS1MAOBMAOALTA4H | |
| SCHEMBL4396426 | 0.89 | BDKRB1 (0.37) | HTR1AHTR7CCR5SOS1HTR2A | |
| SCHEMBL914968 | 0.88 | RHEB (0.42) | HTR1AHTR7SOS1HTR2ADRD3 | |
| Hydrochloric Acid SCHEMBL4403798 | 0.88 | MAOB (0.33) | HTR1AHTR7CCR5HTR2ADRD3 |
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-1720859-B1 | CHEMOKINE RECEPTOR ANTAGONISTS | NOVARTIS AG (CH) | 2009-12-23 | — | — | EP | claimed |