Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.40 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.37 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.37 |
| ▸ | HTR6 | P50406 | 2/20 | 0.37 |
| ▸ | GALR3 | O60755 | 2/20 | 0.37 |
| ▸ | NR2F2 | P24468 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | TNF | P01375 | 1/20 | 0.36 |
| ▸ | EDNRA | P25101 | 1/20 | 0.36 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.36 |
| ▸ | KCNK13 | Q9HB14 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29968198 | 0.89 | DCTPP1 (0.42) | PDE10ADCTPP1AGTR1AGTR2GALR3 | |
| SCHEMBL29968901 | 0.88 | DCTPP1 (0.53) | PDE10ADCTPP1 | |
| SCHEMBL29968012 | 0.86 | NR1H4 (0.46) | DCTPP1AGTR1AGTR2PPARGP2RX3 | |
| SCHEMBL29967971 | 0.86 | PPARG (0.42) | DCTPP1AGTR1AGTR2PPARGP2RX3 | |
| SCHEMBL29968438 | 0.82 | TSHR (0.37) | PPARGP2RX3 | |
| SCHEMBL29967912 | 0.81 | P2RX3 (0.39) | DCTPP1PPARGP2RX3 | |
| SCHEMBL29967953 | 0.81 | PLA2G10 (0.41) | DCTPP1PPARGP2RX3 | |
| SCHEMBL29968268 | 0.81 | KDM4E (0.43) | PDE10AGALR3NR2F2RAB9APPARG | |
| SCHEMBL29967688 | 0.81 | CNR2 (0.38) | PPARGP2RX3 | |
| SCHEMBL29967938 | 0.81 | PPARG (0.42) | AGTR1AGTR2PPARGP2RX3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115260165-B | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2024-08-06 | — | — | CN | disclosed |
| CN-115260165-A | Benzo nitrogen-containing five-membered heterocyclic compound and synthesis and application thereof | 中国科学院上海药物研究所 | 2022-11-01 | — | — | CN | disclosed |