Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EED | O75530 | 4/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22444295 | 0.82 | TSHR (0.50) | EEDKMT2ACHRNB2CHRNA4 | |
| SCHEMBL11633199 | 0.81 | EED (0.56) | EEDKMT2ACHRNB2CHRNA4HRH4 | |
| SCHEMBL3466546 | 0.81 | EED (0.56) | EEDKMT2ACHRNB2CHRNA4HRH4 | |
| SCHEMBL19908818 | 0.81 | EED (0.56) | EEDKMT2ACHRNB2CHRNA4HRH4 | |
| SCHEMBL3466544 | 0.81 | EED (0.56) | EEDKMT2ACHRNB2CHRNA4HRH4 | |
| SCHEMBL2389281 | 0.80 | SLC6A4 (0.58) | HRH4HRH3ALDH1A1POLB | |
| SCHEMBL386760 | 0.79 | HSPA5 (0.46) | HRH3ALDH1A1POLB | |
| SCHEMBL18726535 | 0.79 | HSPA5 (0.46) | HRH3ALDH1A1POLB | |
| SCHEMBL818681 | 0.78 | EED (0.50) | EEDKMT2ACHRNB2CHRNA4HRH4 | |
| SCHEMBL6019475 | 0.78 | EED (0.50) | EEDKMT2ACHRNB2CHRNA4HRH4 |
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-112321534-A | Preparation method of high-purity medicinal roxatidine acetate hydrochloride | 哈药集团技术中心 | 2021-02-05 | — | — | CN | claimed |