Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 2/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29968115 | 0.83 | JAK2 (0.51) | ALDH1A1CYP2C9ALOX15CYP2C19JAK2 | |
| SCHEMBL3872066 | 0.83 | JAK2 (0.51) | ALDH1A1CYP2C9ALOX15CYP2C19JAK2 | |
| Hydrochloric Acid SCHEMBL27081766 | 0.82 | JAK2 (0.50) | ALDH1A1CYP2C9ALOX15CYP2C19JAK2 | |
| SCHEMBL12931800 | 0.80 | SNCA (0.46) | ACHECRBNALDH1A1CYP2C9ALOX15 | |
| Hydrochloric Acid SCHEMBL1271624 | 0.78 | SNCA (0.45) | ACHECRBNALDH1A1CYP2C9ALOX15 | |
| SCHEMBL30026444 | 0.78 | KMT2A (0.53) | ACHEALDH1A1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL29906783 | 0.78 | ALDH1A1 (0.47) | CRBNALDH1A1ALOX15HDAC3HDAC4 | |
| SCHEMBL2898350 | 0.78 | ALDH1A1 (0.47) | CRBNALDH1A1ALOX15HDAC3HDAC4 | |
| Hydrochloric Acid SCHEMBL29940234 | 0.77 | ALDH1A1 (0.46) | CRBNALDH1A1ALOX15HDAC3HDAC4 | |
| Hydrochloric Acid SCHEMBL3102567 | 0.77 | ALDH1A1 (0.46) | CRBNALDH1A1ALOX15HDAC3HDAC4 |
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-107074816-B | Heterocyclic derivative, preparation method and medical application thereof | 四川海思科制药有限公司 | 2020-07-17 | — | — | CN | disclosed |