Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.39 |
| ▸ | TDP2 | O95551 | 3/20 | 0.37 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | SMYD3 | Q9H7B4 | 4/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | RARG | P13631 | 2/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22696301 | 0.83 | LMNA (0.44) | HTTGSK3BCCNB2CDK1CCNB1 | |
| SCHEMBL17974655 | 0.69 | PDK2 (0.44) | GSK3BCCNB2CDK1CCNB1CCNB3 | |
| SCHEMBL31518440 | 0.67 | HTT (0.57) | HTTGSK3BCCNB2CDK1CCNB1 | |
| SCHEMBL29713338 | 0.66 | TDP2 (0.66) | HTTGSK3BCCNB2CDK1CCNB1 | |
| SCHEMBL398818 | 0.66 | TDP2 (0.66) | HTTGSK3BCCNB2CDK1CCNB1 | |
| SCHEMBL6209027 | 0.66 | NOTUM (0.46) | HSD17B10RARGRARBDDB1CRBN | |
| SCHEMBL6352617 | 0.66 | ALDH1A1 (0.47) | HTTGSK3BCCNB2CDK1CCNB1 | |
| SCHEMBL10148390 | 0.64 | RARG (0.56) | HSD17B10L3MBTL1RARGRARBPOLB | |
| SCHEMBL22689317 | 0.64 | IDO1 (0.35) | HSD17B10RARGRARBSMN1; SMN2ALDH1A1 | |
| SCHEMBL30104080 | 0.64 | HTT (0.42) | HTTGSK3BCCNB2CDK1CCNB1 |
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-117624179-A | 3- (amino) methylene indoline derivative and preparation method and application thereof | 徐诺药业(南京)有限公司 | 2024-03-01 | — | — | CN | disclosed |