Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPB1 | P04792 | 6/20 | 0.55 |
| ▸ | CRHBP | P24387 | 1/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2443486 | 0.84 | HSPB1 (0.58) | HSPB1MAPTHTTGAATDP1 | |
| SCHEMBL29549341 | 0.84 | HSPB1 (0.58) | HSPB1MAPTHTTGAATDP1 | |
| SCHEMBL28511295 | 0.82 | HSPB1 (0.56) | HSPB1MAPTHTTGAATDP1 | |
| SCHEMBL3322580 | 0.81 | SMN1; SMN2 (0.51) | HSPB1CRHBPCRHR2MAPTLMNA | |
| SCHEMBL2531644 | 0.78 | HSPB1 (0.57) | HSPB1CRHBPCRHR2MAPTLMNA | |
| SCHEMBL8867069 | 0.78 | HSPB1 (0.57) | HSPB1CRHBPCRHR2MAPTLMNA | |
| SCHEMBL28906973 | 0.76 | LMNA (0.46) | HSPB1MAPTLMNAHTTGAA | |
| SCHEMBL1898099 | 0.76 | ALDH1A1 (0.46) | MAPTLMNAHTTGAATDP1 | |
| SCHEMBL21904820 | 0.75 | HSPB1 (0.71) | HSPB1CRHBPCRHR2MAPTLMNA | |
| SCHEMBL31395357 | 0.75 | HSPB1 (0.71) | HSPB1CRHBPCRHR2MAPTLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112300154-B | Nitrogen-containing heterocyclic compound, preparation method and application thereof | 上海弘翊生物科技有限公司 | 2023-01-24 | — | — | CN | disclosed |
| CN-112300154-A | Nitrogen-containing heterocyclic compound, preparation method and application thereof | 上海弘翊生物科技有限公司 | 2021-02-02 | — | — | CN | disclosed |