Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.52 |
| ▸ | NOS2 | P35228 | 1/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29357398 | 0.80 | NOS3 (0.52) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| SCHEMBL2082377 | 0.80 | NOS3 (0.52) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| SCHEMBL25403401 | 0.80 | NOS3 (0.52) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| SCHEMBL5213660 | 0.80 | NOS3 (0.52) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| Hydrochloric Acid SCHEMBL29085458 | 0.78 | NOS3 (0.50) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| Bromide SCHEMBL29085463 | 0.78 | NOS3 (0.50) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| Hydrochloric Acid SCHEMBL29085462 | 0.78 | NOS3 (0.50) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| SCHEMBL1988876 | 0.77 | NOS3 (0.48) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| SCHEMBL18534884 | 0.76 | NOS3 (0.47) | NOS3NOS2ADRB1MAPK1ADRB2 | |
| SCHEMBL21645919 | 0.76 | NOS3 (0.47) | NOS3NOS2ADRB1MAPK1ADRB2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109843891-A | Oxadiazolopyridine derivatives as ghrelin O-acyltransferase (GOAT) inhibitors | 勃林格殷格翰国际有限公司 | 2019-06-04 | — | — | CN | disclosed |