Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.54 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12039946 | 0.78 | HSP90AA1 (0.54) | HSP90AA1ABCB1ADORA2AADORA1LMNA | |
| SCHEMBL3950023 | 0.78 | SMN1; SMN2 (0.47) | LMNAKDM4EALDH1A1HPGDHASPIN | |
| SCHEMBL9846595 | 0.77 | HSP90AA1 (0.75) | HSP90AA1ABCB1ADORA2AADORA1LMNA | |
| SCHEMBL10916068 | 0.77 | HSP90AA1 (0.75) | HSP90AA1ABCB1ADORA2AADORA1LMNA | |
| SCHEMBL21273912 | 0.76 | HSP90AA1 (0.50) | HSP90AA1ABCB1ADORA2AADORA1LMNA | |
| SCHEMBL3879885 | 0.76 | SMN1; SMN2 (0.54) | LMNAKDM4EALDH1A1HPGDHASPIN | |
| SCHEMBL3526925 | 0.73 | RAB9A (0.53) | HSP90AA1ADORA2AADORA1LMNAALDH1A1 | |
| SCHEMBL28665816 | 0.71 | ADORA2A (0.52) | HSP90AA1ABCB1ADORA2AADORA1LMNA | |
| SCHEMBL15174189 | 0.71 | ABCB1 (0.55) | HSP90AA1ABCB1LMNAKDM4EALDH1A1 | |
| SCHEMBL4956793 | 0.70 | HSP90AB1 (0.48) | HSP90AA1ABCB1LMNAHASPINNPC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113831347-A | 6, 7-disubstituted 2- (ethylthio) -pteridine-4-amine derivative and preparation method and application thereof | 广东海洋大学 | 2021-12-24 | — | — | CN | claimed |
| CN-113831347-B | 6, 7-disubstituted 2- (ethylthio) -pteridine-4-amine derivative and preparation method and application thereof | 广东海洋大学 | 2022-10-04 | — | — | CN | disclosed |
| CN-113831347-B | 6, 7-disubstituted 2- (ethylthio) -pteridine-4-amine derivative and preparation method and application thereof | 广东海洋大学 | 2022-10-04 | — | — | CN | disclosed |
| CN-113831347-A | 6, 7-disubstituted 2- (ethylthio) -pteridine-4-amine derivative and preparation method and application thereof | 广东海洋大学 | 2021-12-24 | — | — | CN | disclosed |
| CN-113831347-A | 6, 7-disubstituted 2- (ethylthio) -pteridine-4-amine derivative and preparation method and application thereof | 广东海洋大学 | 2021-12-24 | — | — | CN | disclosed |