Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 5/20 | 0.46 |
| ▸ | HCRTR2 | O43614 | 4/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | CCR3 | P51677 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL4960742 | 0.88 | ABCB1 (0.40) | HCRTR1HCRTR2KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL4316050 | 0.85 | SPR (0.45) | HRH1CCR3KCNH2 | |
| SCHEMBL4962104 | 0.74 | HCRTR1 (0.35) | HCRTR1HCRTR2HRH3KCNH2 | |
| SCHEMBL4309877 | 0.72 | ALDH1A1 (0.36) | HRH3KDM4EALDH1A1SMN1; SMN2POLB | |
| SCHEMBL4304614 | 0.72 | SPR (0.44) | KDM4EALDH1A1SMN1; SMN2ATMABCB1 | |
| SCHEMBL4308699 | 0.71 | SPR (0.48) | KDM4EALDH1A1SMN1; SMN2ATMABCB1 | |
| SCHEMBL4964653 | 0.71 | DRD4 (0.42) | — | |
| SCHEMBL4962457 | 0.70 | F2 (0.35) | HRH3POLBKCNH2 | |
| SCHEMBL4962541 | 0.69 | HRH3 (0.35) | HRH3POLBKCNH2 | |
| SCHEMBL4962995 | 0.68 | DAGLA (0.41) | KDM4EALDH1A1SMN1; SMN2 |
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-1879873-A1 | NEUROTHERAPEUTIC AZOLE COMPOUNDS | SK Holdings Co., Ltd. (KR) | 2008-01-23 | — | — | EP | disclosed |
| WO-2006112685-A1 | NEUROTHERAPEUTIC AZOLE COMPOUNDS | SK HOLDINGS CO., LTD. (KR) | 2006-10-26 | — | — | WO | disclosed |