Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | GALR3 | O60755 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24512733 | 0.87 | MAPT (0.47) | RAB9ASMN1; SMN2P2RX3CYP2C9CYP1A2 | |
| SCHEMBL4859054 | 0.87 | TDP1 (0.51) | RAB9ASMN1; SMN2P2RX3CYP1A2ALDH1A1 | |
| SCHEMBL17591033 | 0.85 | P2RX3 (0.55) | RAB9ASMN1; SMN2NPC1P2RX3CYP2C9 | |
| SCHEMBL29826782 | 0.85 | P2RX3 (0.55) | RAB9ASMN1; SMN2NPC1P2RX3CYP2C9 | |
| SCHEMBL22518516 | 0.79 | MAPK1 (0.44) | RAB9ASMN1; SMN2NPC1CYP2C9TP53 | |
| SCHEMBL6014711 | 0.78 | KDR (0.49) | P2RX3ALDH1A1PDGFRAKDRGALR3 | |
| SCHEMBL24124575 | 0.75 | TDP1 (0.67) | RAB9ASMN1; SMN2NPC1TP53ALDH1A1 | |
| SCHEMBL24920948 | 0.74 | ACACB (0.42) | RAB9ASMN1; SMN2NPC1P2RX3ALDH1A1 | |
| SCHEMBL4384494 | 0.74 | MAPK1 (0.46) | RAB9ASMN1; SMN2NPC1CYP2C9TP53 | |
| SCHEMBL22676056 | 0.74 | SCN9A (0.45) | RAB9ASMN1; SMN2NPC1CYP2C9ALDH1A1 |
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-117043154-A | GPCR receptor agonists, pharmaceutical compositions comprising same, and methods of use thereof | 卡莫特医疗有限公司 | 2023-11-10 | — | — | CN | disclosed |