Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 6/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | APAF1 | O14727 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | NSD2 | O96028 | 1/20 | 0.43 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.43 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.43 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.43 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11845974 | 0.76 | GGPS1 (0.44) | ADORA2AADORA1POLBRAB9AAPAF1 | |
| SCHEMBL28061277 | 0.73 | KDM4E (0.52) | ADORA2AADORA1POLBRAB9AAPAF1 | |
| SCHEMBL4825949 | 0.73 | NPC1 (0.49) | ADORA2ARAB9ANPC1MAPTKDM4E | |
| SCHEMBL27974324 | 0.69 | MAPT (0.41) | RAB9ANPC1CYP19A1MAPTKDM4E | |
| SCHEMBL9352344 | 0.68 | POLB (0.46) | ADORA2AADORA1POLBRAB9AAPAF1 | |
| SCHEMBL29669934 | 0.66 | GABRG2 (0.36) | RAB9ANPC1MAPTHSD17B10KDM4E | |
| SCHEMBL5425277 | 0.66 | POLB (0.43) | ADORA2AADORA1POLBRAB9AAPAF1 | |
| SCHEMBL358864 | 0.65 | ADORA2A (0.42) | ADORA2AADORA1MAPTKDM4EALDH1A1 | |
| SCHEMBL996451 | 0.65 | ADORA2A (0.42) | ADORA2AADORA1MAPTHSD17B10KDM4E | |
| SCHEMBL4184827 | 0.65 | KDM4E (0.39) | MAPTKDM4EALDH1A1TDP1HPGD |
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-110357901-B | Aromatic ring vinyl thieno pyrimidine compound, preparation method and application of compound | 安徽医科大学 | 2020-06-23 | — | — | CN | disclosed |