Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 5/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 5/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 5/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 5/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 5/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 5/20 | 0.35 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.32 |
| ▸ | CCR2 | P41597 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL27739501 | 0.87 | MAPT (0.40) | MAPTALOX15GRIN2DGRIN3BGRIN1 | |
| SCHEMBL27739345 | 0.82 | MAPT (0.43) | MAPTALOX15GRIN2DGRIN3BGRIN1 | |
| SCHEMBL28026039 | 0.77 | MAPT (0.44) | MAPTALOX15GRIN2DGRIN3BGRIN1 | |
| SCHEMBL27717941 | 0.77 | GRIN2D (0.48) | MAPTALOX15GRIN2DGRIN3BGRIN1 | |
| SCHEMBL28026498 | 0.75 | MAPT (0.45) | MAPTALOX15GRIN2DGRIN3BGRIN1 | |
| SCHEMBL3109196 | 0.74 | BIRC2 (0.42) | BIRC2 | |
| SCHEMBL28026504 | 0.72 | MAPT (0.70) | MAPTALOX15GRIN2DGRIN3BGRIN1 | |
| SCHEMBL28046062 | 0.71 | GRIN2D (0.48) | MAPTALOX15GRIN2DGRIN3BGRIN1 | |
| SCHEMBL3097792 | 0.71 | LTA4H (0.30) | — | |
| SCHEMBL28654537 | 0.71 | GRIN2D (0.42) | MAPTALOX15GRIN2DGRIN3BGRIN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1974560-B | Compound 3-isopropyl-6-(2-methylbutyl) piperazine-2,5-dione and its preparation and application | NO 2 MILITARY MEDICAL UNIVERSITY PLA | 2010-09-08 | — | — | CN | claimed |
| CN-1974560-A | Compound 3-isopropyl-6-(2-methylbutyl) piperazine-2,5-dione and its prepn and application | UNIV PLA 2ND MILITARY MEDICAL (CN) | 2007-06-06 | — | — | CN | claimed |