Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.60 |
| ▸ | PDE5A | O76074 | 2/20 | 0.60 |
| ▸ | HTR2A | P28223 | 1/20 | 0.56 |
| ▸ | DRD3 | P35462 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | CTNNB1 | P35222 | 6/20 | 0.52 |
| ▸ | TCF7L2 | Q9NQB0 | 6/20 | 0.52 |
| ▸ | HTR3A | P46098 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3640608 | 0.93 | HRH4 (0.69) | HRH4PDE5AHTR2ADRD3KDM4E | |
| SCHEMBL3638488 | 0.93 | HRH4 (0.69) | HRH4PDE5AHTR2ADRD3KDM4E | |
| SCHEMBL3641800 | 0.82 | HRH4 (0.72) | HRH4PDE5AHTR2ADRD3KDM4E | |
| SCHEMBL13009783 | 0.81 | ACHE (0.66) | HRH4PDE5AHTR2ADRD3KDM4E | |
| SCHEMBL3640288 | 0.79 | PDE5A (0.68) | HRH4PDE5AHTR2ADRD3KDM4E | |
| SCHEMBL3644233 | 0.78 | PDE5A (0.67) | HRH4PDE5AHTR2ADRD3KDM4E | |
| SCHEMBL3640234 | 0.76 | HRH4 (1.00) | HRH4PDE5AHTR2ADRD3KDM4E | |
| SCHEMBL27808528 | 0.75 | CTNNB1 (0.68) | HRH4PDE5AHTR2ADRD3KDM4E | |
| Hydrochloric Acid SCHEMBL3637430 | 0.75 | HRH4 (0.97) | HRH4PDE5AHTR2ADRD3KDM4E | |
| SCHEMBL2628837 | 0.75 | PDE5A (0.79) | HRH4PDE5AHTR2ADRD3KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2173346-A2 | USE OF COMPOUNDS FOR PREPARING ANTI-TUBERCULOSIS AGENTS | Summit Corporation Plc (GB) | 2010-04-14 | — | — | EP | disclosed |
| WO-2009001060-A2 | USE OF COMPOUNDS FOR PREPARING ANTI-TUBERCULOSIS AGENTS | SUMMIT CORPORATION PLC (GB) | 2008-12-31 | — | — | WO | disclosed |