Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ACACB | O00763 | 6/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.36 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28028552 | 0.86 | L3MBTL1 (0.50) | KMT2ASMN1; SMN2MEN1ALDH1A1MAPT | |
| SCHEMBL27911352 | 0.77 | LMNA (0.42) | KMT2AMEN1ALDH1A1L3MBTL1KCNH2 | |
| SCHEMBL1974946 | 0.76 | P4HTM (0.52) | KMT2AHTTSMN1; SMN2ACACBNPSR1 | |
| SCHEMBL1973974 | 0.76 | KMT2A (0.48) | KMT2AHTTSMN1; SMN2ACACBMEN1 | |
| SCHEMBL27931886 | 0.76 | HDAC1 (0.39) | KMT2AHTTSMN1; SMN2ALDH1A1L3MBTL1 | |
| SCHEMBL26401405 | 0.75 | HTT (0.43) | KMT2AHTTSMN1; SMN2ACACBMEN1 | |
| SCHEMBL29706051 | 0.75 | HTT (0.43) | KMT2AHTTSMN1; SMN2ACACBMEN1 | |
| SCHEMBL28749827 | 0.75 | HTT (0.43) | KMT2AHTTSMN1; SMN2ACACBMEN1 | |
| SCHEMBL17668770 | 0.75 | KMT2A (0.47) | KMT2AHTTSMN1; SMN2ACACBMEN1 | |
| SCHEMBL2713868 | 0.75 | L3MBTL1 (0.55) | KMT2AHTTSMN1; SMN2MEN1NPSR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102958922-B | 2,5,6,7-tetrahydrochysene-[Isosorbide-5-Nitrae] oxygen azepine *-3-base amine or 2,3,6,7-tetrahydrochysene-[Isosorbide-5-Nitrae] oxygen azepine *-5-ylamine compounds | HOFFMAN-LA ROCHE LTD. (CH) | 2015-09-30 | — | — | CN | disclosed |
| CN-103502227-A | 1 as BACE1 and/or BACE2 inhibitors | HOFFMANN LA ROCHE | 2014-01-08 | — | — | CN | disclosed |
| 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 |
| CN-102712609-A | 2-amino-5, 5-difluoro-5, 6-dihydro-4H-oxazines as BACE1 and/or BACE2 inhibitors | HOFFMANN LA ROCHE | 2012-10-03 | — | — | CN | disclosed |