Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH2 | P48735 | 2/20 | 0.56 |
| ▸ | KIF11 | P52732 | 1/20 | 0.55 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.54 |
| ▸ | EGFR | P00533 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | MTOR | P42345 | 1/20 | 0.53 |
| ▸ | IGF1R | P08069 | 2/20 | 0.52 |
| ▸ | AURKA | O14965 | 2/20 | 0.50 |
| ▸ | CTSC | P53634 | 1/20 | 0.50 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.50 |
| ▸ | ALPL | P05186 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ULK1 | O75385 | 1/20 | 0.48 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29801795 | 1.00 | IDH2 (0.56) | IDH2KIF11ABCG2EGFRTSHR | |
| SCHEMBL2111139 | 0.80 | KDM4E (0.58) | HTTIGF1RKDM4EALDH1A1MAPT | |
| SCHEMBL1702912 | 0.79 | IGF1R (0.48) | IGF1RTRPV1ALPLULK1SLC22A12 | |
| SCHEMBL18796092 | 0.79 | ALPL (0.48) | IGF1RTRPV1ALPLULK1SLC22A12 | |
| SCHEMBL878873 | 0.78 | CDK8 (0.59) | IDH2KIF11AURKACTSCKDM4E | |
| SCHEMBL7697641 | 0.78 | AURKA (0.54) | IDH2KIF11ABCG2EGFRTSHR | |
| SCHEMBL17742433 | 0.78 | IGF1R (0.51) | ABCG2IGF1RKDM4ERAB9ASMN1; SMN2 | |
| SCHEMBL3952943 | 0.78 | IGF1R (0.72) | ABCG2EGFRIGF1RALPLKDM4E | |
| SCHEMBL394991 | 0.78 | KIF11 (0.70) | IDH2KIF11HTTAURKAKDM4E | |
| SCHEMBL23553607 | 0.77 | VCP (0.64) | ABCG2MTORKDM4EMAPT |
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-114736156-A | Preparation method and application of simplified derivatives of cryptolepine | 中捷四方生物科技股份有限公司 | 2022-07-12 | — | — | CN | disclosed |