Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 4/20 | 0.45 |
| ▸ | CCND1 | P24385 | 4/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.38 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29479213 | 1.00 | CDK4 (0.45) | CDK4CCND1NOTUMSMN1; SMN2PBRM1 | |
| SCHEMBL9804292 | 1.00 | CDK4 (0.45) | CDK4CCND1NOTUMSMN1; SMN2PBRM1 | |
| SCHEMBL3334605 | 0.79 | CDK4 (0.39) | CDK4CCND1NOTUMSMN1; SMN2PBRM1 | |
| SCHEMBL29236 | 0.77 | SLC6A2 (0.41) | CDK4CCND1NOTUMSMN1; SMN2PBRM1 | |
| SCHEMBL11787645 | 0.76 | CDK4 (0.54) | CDK4CCND1NOTUML3MBTL1HTR2A | |
| SCHEMBL29479215 | 0.72 | HTR2A (0.45) | CDK4CCND1HTR2AHTR2CALDH1A1 | |
| SCHEMBL29812 | 0.69 | CDK4 (0.56) | CDK4CCND1NOTUMHTR2AHTR2C | |
| SCHEMBL29384135 | 0.69 | CDK4 (0.56) | CDK4CCND1NOTUMHTR2AHTR2C | |
| SCHEMBL598296 | 0.68 | SLC6A2 (0.47) | CDK4CCND1NOTUMSLC6A2 | |
| SCHEMBL321199 | 0.68 | CDK4 (0.45) | CDK4CCND1NOTUMSMN1; SMN2PBRM1 |
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-112708902-B | Method for electrochemically synthesizing indole compounds | 中国科学技术大学 | 2022-03-01 | — | — | CN | disclosed |