Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 15/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.36 |
| ▸ | MEN1 | O00255 | 6/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.36 |
| ▸ | GAA | P10253 | 6/20 | 0.36 |
| ▸ | HPGD | P15428 | 6/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7166909 | 0.90 | HRH3 (0.40) | HRH3ALDH1A1KDM4EMEN1KMT2A | |
| Ammonia Solution, Strong SCHEMBL29032591 | 0.88 | HRH3 (0.39) | HRH3ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL4636270 | 0.75 | ALDH1A1 (0.43) | LMNAALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL2967658 | 0.75 | KDM4E (0.36) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL28754992 | 0.74 | ALDH1A1 (0.37) | HRH3LMNAALDH1A1KDM4EMEN1 | |
| SCHEMBL20305412 | 0.73 | CLK1 (0.43) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL7075268 | 0.72 | ALDH1A1 (0.43) | HRH3ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL25169306 | 0.71 | KDM4E (0.47) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL15483316 | 0.70 | ALDH1A1 (0.42) | LMNAALDH1A1KDM4EMEN1KMT2A | |
| Formamide SCHEMBL28844193 | 0.70 | HRH3 (0.38) | HRH3ALDH1A1KDM4EMEN1KMT2A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116444515-A | Di-ring derivative-containing inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-07-18 | — | — | CN | disclosed |
| CN-115974897-A | Bicyclic derivative-containing inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-04-18 | — | — | CN | disclosed |
| CN-112368283-B | Bicyclic derivative-containing inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-02-17 | — | — | CN | disclosed |
| CN-115073449-A | Fused ring heterocyclic compound and application thereof, and pharmaceutical composition containing fused ring heterocyclic compound and application thereof | 浙江大学 | 2022-09-20 | — | — | CN | disclosed |
| CN-115068471-A | Application of fused ring heterocyclic compound or pharmaceutically acceptable salt thereof in preparation of drugs for treating Parkinson's disease | 浙江大学 | 2022-09-20 | — | — | CN | disclosed |
| CN-115073448-A | Application of fused ring heterocyclic compound or pharmaceutically acceptable salt thereof in preparation of medicine for treating cerebral apoplexy | 浙江大学 | 2022-09-20 | — | — | CN | disclosed |
| CN-112368283-A | Bicyclic derivative-containing inhibitor, preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2021-02-12 | — | — | CN | disclosed |