Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.34 |
| ▸ | PARP1 | P09874 | 2/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | GALR3 | O60755 | 1/20 | 0.32 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8918630 | 1.00 | IKBKB (0.47) | IKBKBKDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL8919045 | 0.78 | PARP1 (0.38) | IKBKBKDM4EALDH1A1SMN1; SMN2PARP1 | |
| SCHEMBL28024070 | 0.73 | IKBKB (0.55) | IKBKBKDM4EALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL7135872 | 0.72 | IKBKB (0.54) | IKBKBKDM4EALDH1A1GAAKMT2A | |
| SCHEMBL19329179 | 0.70 | IKBKB (0.67) | IKBKBKDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL8919833 | 0.69 | — | — | |
| SCHEMBL8918540 | 0.68 | — | — | |
| SCHEMBL31443745 | 0.67 | IKBKB (0.67) | IKBKBKDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL22388 | 0.67 | IKBKB (0.67) | IKBKBKDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL26136515 | 0.67 | IKBKB (0.50) | IKBKBKDM4EALDH1A1GAAKMT2A |
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-5691366-A | UNSATURATED NITRO OXIME FORMED BY REACTION OF DINITROGEN TRIOXIDE WITH DIOLEFIN ETHER, SULFIDE OR AMINE TO BE USED AS VASODILATORS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-11-25 | — | — | US | disclosed |