Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.39 |
| ▸ | ORAI1 | Q96D31 | 3/20 | 0.38 |
| ▸ | ORAI2 | Q96SN7 | 3/20 | 0.38 |
| ▸ | ORAI3 | Q9BRQ5 | 3/20 | 0.38 |
| ▸ | TRPV6 | Q9H1D0 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CA4 | P22748 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.33 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.33 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30901036 | 0.69 | ALDH1A1 (0.40) | TSHRALDH1A1LMNACA4CA7 | |
| SCHEMBL167124 | 0.64 | — | — | |
| Phenol SCHEMBL18010563 | 0.62 | TSHR (0.44) | TSHRORAI1ORAI2ORAI3TRPV6 | |
| SCHEMBL142660 | 0.62 | ALDH1A1 (0.40) | TSHRALDH1A1LMNACA4CA7 | |
| Biphenyl SCHEMBL151980 | 0.59 | ALDH1A1 (0.69) | TSHRALDH1A1LMNACYP1A2TDP1 | |
| SCHEMBL8128335 | 0.59 | ALDH1A1 (0.38) | TSHRALDH1A1LMNACA4CA7 | |
| Iodide SCHEMBL9634755 | 0.59 | ALDH1A1 (0.38) | TSHRALDH1A1LMNACA4CA7 | |
| Hydrochloric Acid SCHEMBL2273464 | 0.59 | ALDH1A1 (0.38) | TSHRALDH1A1LMNACA4CA7 | |
| SCHEMBL24715429 | 0.56 | TSHR (1.00) | TSHRORAI1ORAI2ORAI3TRPV6 | |
| Phenol SCHEMBL4184679 | 0.56 | TDP1 (0.44) | TSHRORAI1ORAI2ORAI3TRPV6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115215813-A | Method for controlling valsartan impurity | 江苏新瑞药业有限公司 | 2022-10-21 | — | — | CN | claimed |
| CN-115215813-A | Method for controlling valsartan impurity | 江苏新瑞药业有限公司 | 2022-10-21 | — | — | CN | disclosed |
| CN-115215813-A | Method for controlling valsartan impurity | 江苏新瑞药业有限公司 | 2022-10-21 | — | — | CN | disclosed |
| CN-105198758-A | Method for preparing high purity (Z)-tamoxifen | UNIV HUNAN | 2015-12-30 | — | — | CN | disclosed |