Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | HCRTR1 | O43613 | 7/20 | 0.53 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.53 |
| ▸ | KDM1A | O60341 | 1/20 | 0.50 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.48 |
| ▸ | HRH2 | P25021 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.45 |
| ▸ | KLK7 | P49862 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6612547 | 0.94 | NPC1 (0.57) | CHEK2NPC1HPGDRAB9AHCRTR1 | |
| SCHEMBL5046246 | 0.92 | CHEK2 (0.54) | CHEK2NPC1HPGDRAB9AHCRTR1 | |
| SCHEMBL4312971 | 0.92 | CHEK2 (0.54) | CHEK2NPC1HPGDRAB9AHCRTR1 | |
| SCHEMBL4317069 | 0.92 | CHEK2 (0.52) | CHEK2NPC1HPGDRAB9AHCRTR1 | |
| SCHEMBL7359533 | 0.92 | PRMT5 (0.58) | CHEK2NPC1HPGDRAB9AHCRTR1 | |
| SCHEMBL7324862 | 0.92 | CHEK2 (0.58) | CHEK2NPC1HPGDRAB9AHCRTR1 | |
| SCHEMBL7399721 | 0.90 | CHEK2 (0.61) | CHEK2NPC1HPGDRAB9AHCRTR1 | |
| SCHEMBL7324359 | 0.89 | HCRTR1 (0.54) | CHEK2NPC1HPGDRAB9AHCRTR1 | |
| SCHEMBL6615093 | 0.89 | HCRTR1 (0.58) | CHEK2HCRTR1HCRTR2HRH2HRH1 | |
| SCHEMBL6613800 | 0.87 | CHEK2 (0.52) | CHEK2NPC1HPGDRAB9AHCRTR1 |
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-1435955-A2 | N-AROYL CYCLIC AMINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | SmithKline Beecham P.L.C. (GB) | 2004-07-14 | — | — | EP | disclosed |
| WO-2002089800-A2 | N-AROYL CYCLIC AMINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-11-14 | — | — | WO | disclosed |