Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.31 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.30 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.30 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.30 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.30 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.30 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.30 |
| ▸ | SNCA | P37840 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 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 | |
|---|---|---|---|---|
| SCHEMBL11233516 | 0.85 | NPC1 (0.32) | NPC1JAK2HTTRAB9ASMN1; SMN2 | |
| SCHEMBL11235046 | 0.77 | GRIN2D (0.37) | HTTLOXL2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL11227704 | 0.77 | ALDH1A1 (0.38) | NPC1JAK2HTTRAB9ASMN1; SMN2 | |
| SCHEMBL27703640 | 0.75 | CASP6 (0.46) | HTT | |
| SCHEMBL27478538 | 0.75 | PTPN1 (0.41) | HTTALDH1A1 | |
| SCHEMBL8854245 | 0.74 | TAAR1 (0.43) | ALDH1A1 | |
| SCHEMBL9322428 | 0.73 | LOXL2 (0.42) | ALDH1A1LOXL2 | |
| SCHEMBL11221886 | 0.73 | SNCA (0.44) | HTTNPSR1ALDH1A1SNCA | |
| SCHEMBL11226009 | 0.73 | ALDH1A1 (0.34) | NPC1JAK2HTTRAB9ASMN1; SMN2 | |
| SCHEMBL27521605 | 0.73 | ALDH1A1 (0.40) | HTTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4341898-A | DEHYDROGENATION-ISOMERIZATION REACTION IN PRESENCE OF LEWIS ACID | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1982-07-27 | — | — | US | disclosed |