Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | APLNR | P35414 | 2/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 4/20 | 0.31 |
| ▸ | KDR | P35968 | 4/20 | 0.31 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27860279 | 0.79 | APLNR (0.38) | DGAT1KAT6AALDH1A1L3MBTL1APLNR | |
| SCHEMBL27628648 | 0.75 | CYP1A2 (0.44) | ALDH1A1KMT2AMEN1LMNANPC1 | |
| SCHEMBL27913950 | 0.74 | TGM2 (0.39) | ALDH1A1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL16952185 | 0.71 | LMNA (0.33) | DGAT1APLNRLMNA | |
| SCHEMBL9515508 | 0.71 | APLNR (0.48) | DGAT1ALDH1A1L3MBTL1APLNRACACB | |
| SCHEMBL933449 | 0.69 | ALDH1A1 (0.33) | ALDH1A1KMT2AMEN1LMNAKDM4E | |
| SCHEMBL27697290 | 0.68 | DGAT1 (0.42) | DGAT1ALDH1A1L3MBTL1APLNRACACB | |
| SCHEMBL21470340 | 0.68 | MEN1 (0.33) | KAT6AAPLNRACACBKMT2AMEN1 | |
| SCHEMBL7222153 | 0.68 | HDAC4 (0.43) | ALDH1A1KDM4E | |
| SCHEMBL7222151 | 0.68 | HDAC4 (0.43) | ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-102958922-A | 2,5,6,7-tetrahydro-[1,4]oxazepin-3-ylamine or 2,3,6,7-tetrahydro-[1,4]oxazepin-5-ylamine compounds | HOFFMANN LA ROCHE | 2013-03-06 | — | — | CN | disclosed |