Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 18/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.65 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.64 |
| ▸ | HPGD | P15428 | 11/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.56 |
| ▸ | USP2 | O75604 | 2/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6254905 | 0.86 | KDM4E (0.70) | KDM4EHSD17B10ALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL6252358 | 0.81 | KDM4E (1.00) | KDM4EHSD17B10ALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL17351373 | 0.80 | KDM4E (0.97) | KDM4EHSD17B10ALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL16014103 | 0.80 | ADORA2A (0.52) | KDM4EHSD17B10ALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL1177057 | 0.79 | KDM4E (1.00) | KDM4EHSD17B10ALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL6251113 | 0.78 | HPGD (0.70) | KDM4EHSD17B10ALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL6252484 | 0.78 | KDM4E (0.73) | KDM4EHSD17B10ALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL17351623 | 0.76 | ALDH1A1 (0.52) | KDM4EHSD17B10ALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL6255004 | 0.75 | HPGD (0.52) | KDM4EHSD17B10ALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL31120389 | 0.75 | KDM4E (0.78) | KDM4EHSD17B10ALDH1A1ADORA2ASMN1; 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-2964644-A1 | PERFLUORINATED CYCLOPROPYL FUSED 1,3-OXAZIN-2-AMINE COMPOUNDS AS BETA-SECRETASE INHIBITORS AND METHODS OF USE | Amgen Inc. (US) | 2016-01-13 | — | — | EP | disclosed |
| WO-2014138484-A1 | PERFLUORINATED CYCLOPROPYL FUSED 1,3-OXAZIN-2-AMINE COMPOUNDS AS BETA-SECRETASE INHIBITORS AND METHODS OF USE | AMGEN INC. (US) | 2014-09-12 | — | — | WO | disclosed |