Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 4/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.46 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TRPV4 | Q9HBA0 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL452172 | 0.86 | ALDH1A1 (0.61) | CXCR3KCNH2HRH3ALDH1A1LMNA | |
| SCHEMBL1553219 | 0.85 | CXCR3 (0.52) | CXCR3 | |
| SCHEMBL451131 | 0.85 | NPC1 (0.52) | CXCR3KCNH2HRH3PIK3CGALDH1A1 | |
| SCHEMBL450061 | 0.84 | CXCR3 (0.54) | CXCR3PIK3CGALDH1A1MEN1KMT2A | |
| SCHEMBL450858 | 0.83 | SMN1; SMN2 (0.57) | CXCR3TP53ALDH1A1LMNAPOLB | |
| SCHEMBL1553514 | 0.83 | HRH3 (0.55) | CXCR3KCNH2HRH3ALDH1A1LMNA | |
| SCHEMBL1553362 | 0.82 | KCNH2 (0.44) | CXCR3KCNH2HRH3PIK3CGTP53 | |
| SCHEMBL447902 | 0.82 | PTGS2 (0.49) | KCNH2HRH3PIK3CGALDH1A1POLB | |
| SCHEMBL453737 | 0.82 | SMN1; SMN2 (0.58) | KCNH2HRH3PIK3CGALDH1A1RAB9A | |
| SCHEMBL450044 | 0.80 | MEN1 (0.47) | CXCR3KCNH2HRH3PIK3CGALDH1A1 |
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-1521746-B1 | QUINAZOLINONE MODULATORS OF NUCLEAR RECEPTORS | X CEPTOR THERAPEUTICS INC (US) | 2011-04-27 | — | — | EP | claimed |