Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | TXNRD1 | Q16881 | 7/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.51 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | GALR3 | O60755 | 1/20 | 0.44 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.42 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30205334 | 0.85 | ALDH1A1 (0.57) | ALDH1A1KDM4EHTTTXNRD1CYP19A1 | |
| SCHEMBL7533291 | 0.82 | TXNRD1 (0.58) | ALDH1A1TXNRD1MAPTLMNAMAPK1 | |
| SCHEMBL7540192 | 0.82 | TXNRD1 (0.55) | ALDH1A1HTTTXNRD1CYP19A1RAB9A | |
| SCHEMBL3991397 | 0.78 | POLB (0.62) | ALDH1A1KDM4EHTTPOLBMCOLN3 | |
| SCHEMBL30205148 | 0.77 | ALDH1A1 (0.53) | ALDH1A1KDM4EHTTTXNRD1POLB | |
| SCHEMBL7540268 | 0.73 | VCAM1 (0.58) | ALDH1A1TXNRD1 | |
| SCHEMBL29029059 | 0.71 | ALDH1A1 (0.50) | ALDH1A1KDM4EHTTPOLBMCOLN3 | |
| SCHEMBL10060156 | 0.71 | ALDH1A1 (0.71) | ALDH1A1KDM4EHTTPOLBMCOLN3 | |
| SCHEMBL6517136 | 0.71 | ALDH1A1 (0.71) | ALDH1A1KDM4EHTTPOLBMCOLN3 | |
| SCHEMBL29029071 | 0.71 | ALDH1A1 (0.49) | ALDH1A1KDM4EHTTPOLBMCOLN3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115710251-A | Myeloid differentiation factor 88 inhibitor and preparation method and application thereof | 杭州医学院 | 2023-02-24 | — | — | CN | claimed |
| CN-115710251-B | Medullary differentiation factor 88 inhibitor and preparation method and application thereof | 杭州医学院 | 2024-05-28 | — | — | CN | disclosed |
| CN-115710251-A | Myeloid differentiation factor 88 inhibitor and preparation method and application thereof | 杭州医学院 | 2023-02-24 | — | — | CN | disclosed |