Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.33 |
| ▸ | APLNR | P35414 | 4/20 | 0.32 |
| ▸ | KDM1A | O60341 | 4/20 | 0.32 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA5A | P35218 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11300627 | 0.80 | DGAT1 (0.37) | DGAT1PTGDR2APLNRKDM1AKDM1B | |
| Hydrochloric Acid SCHEMBL12614486 | 0.78 | DGAT1 (0.36) | DGAT1PTGDR2APLNRKDM1AKDM1B | |
| SCHEMBL27925998 | 0.77 | DGAT1 (0.35) | DGAT1PTGDR2APLNRKDM1AKDM1B | |
| SCHEMBL9953344 | 0.77 | DGAT1 (0.35) | DGAT1KDM1AKDM1BERN1CYP2A6 | |
| SCHEMBL246843 | 0.76 | DGAT1 (0.33) | DGAT1KDM1AKDM1B | |
| SCHEMBL3527105 | 0.75 | PTGDR2 (0.42) | DGAT1PTGDR2PYCR1APLNRKDM1A | |
| SCHEMBL246150 | 0.75 | DGAT1 (0.42) | DGAT1PTGDR2KDM4ENPC1ALDH1A1 | |
| SCHEMBL1173288 | 0.75 | DGAT1 (0.42) | DGAT1PTGDR2KDM4ENPC1ALDH1A1 | |
| SCHEMBL14889830 | 0.75 | DGAT1 (0.42) | DGAT1PTGDR2KDM4ENPC1ALDH1A1 | |
| SCHEMBL1173372 | 0.74 | DGAT1 (0.37) | DGAT1PTGDR2PYCR1APLNRKDM1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011020806-A1 | 3-AMINO-5-PHENYL-5,6-DIHYDRO-2H-[1,4]OXAZINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-02-24 | — | — | WO | disclosed |