Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | CDK4 | P11802 | 4/20 | 0.35 |
| ▸ | CCND1 | P24385 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.33 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | PRKCG | P05129 | 1/20 | 0.33 |
| ▸ | PRKCB | P05771 | 1/20 | 0.33 |
| ▸ | PRKCA | P17252 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22393392 | 0.77 | NOTUM (0.42) | NOTUMCDK4CCND1KMT2ATSHR | |
| SCHEMBL21806773 | 0.71 | NOTUM (0.46) | NOTUMCDK4CCND1KMT2ATSHR | |
| SCHEMBL6041081 | 0.71 | CDK4 (0.42) | NOTUMCDK4CCND1KMT2ATSHR | |
| SCHEMBL14076797 | 0.69 | CDK4 (0.41) | NOTUMCDK4CCND1KMT2ATSHR | |
| SCHEMBL30037074 | 0.68 | KMT2A (0.44) | NOTUMCDK4CCND1KMT2ATSHR | |
| SCHEMBL6041052 | 0.67 | KMT2A (0.40) | NOTUMCDK4CCND1KMT2ATSHR | |
| SCHEMBL6041051 | 0.63 | CDK4 (0.42) | NOTUMCDK4CCND1KMT2ATSHR | |
| SCHEMBL691666 | 0.63 | NOTUM (0.59) | NOTUMTSHRRAB9AL3MBTL1 | |
| SCHEMBL29701136 | 0.63 | NOTUM (0.59) | NOTUMTSHRRAB9AL3MBTL1 | |
| Tert-Butyl Formate SCHEMBL28090886 | 0.63 | CYP2A6 (0.44) | NOTUMCDK4CCND1ALDH1A1HTT |
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-112745350-B | Synthesis method of 4-alkyl phosphonate substituted indole compound | 山东领海生物科技有限公司 | 2022-11-22 | — | — | CN | disclosed |