Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | SLCO1B3 | Q9NPD5 | 3/20 | 0.40 |
| ▸ | SLCO1B1 | Q9Y6L6 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | SLCO2B1 | O94956 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21722694 | 0.91 | XDH (0.48) | XDHCYP2C9ALOX15CYP3A4SLCO1B3 | |
| SCHEMBL21738179 | 0.83 | XDH (0.47) | XDHCYP2C9ALOX15CYP3A4SLCO1B3 | |
| SCHEMBL21722695 | 0.83 | CYP3A4 (0.61) | XDHCYP2C9ALOX15CYP3A4SLCO1B3 | |
| SCHEMBL21722491 | 0.82 | BACE1 (0.60) | ALOX15CYP3A4HSD17B10MAPTALDH1A1 | |
| SCHEMBL21722685 | 0.81 | XDH (0.44) | XDHCYP2C9ALOX15CYP3A4SLCO1B3 | |
| SCHEMBL21722700 | 0.80 | XDH (0.43) | XDHCYP2C9ALOX15CYP3A4SLCO1B3 | |
| SCHEMBL28653165 | 0.79 | XDH (0.57) | XDHCYP2C9ALOX15CYP3A4SLCO1B3 | |
| SCHEMBL21738194 | 0.79 | XDH (0.42) | XDHCYP2C9ALOX15CYP3A4SLCO1B3 | |
| SCHEMBL21738288 | 0.79 | XDH (0.42) | XDHCYP2C9ALOX15CYP3A4SLCO1B3 | |
| Leucocianidol SCHEMBL14339444 | 0.77 | XDH (0.74) | XDHALOX15CYP3A4HSD17B10MAPT |
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-110294732-B | Pharmaceutical compound for treating liver diseases and application thereof | 江苏新元素医药科技有限公司 | 2021-10-26 | — | — | CN | claimed |
| WO-2020035058-A1 | PHARMACEUTICAL COMPOUNDS FOR TREATING LIVER DISEASES AND APPLICATION THEREOF | 江苏新元素医药科技有限公司 | 2020-02-20 | — | — | WO | claimed |
| CN-110294732-A | Medical compounds and its application for treating hepatopathy | 江苏新元素医药科技有限公司 | 2019-10-01 | — | — | CN | claimed |
| CN-110294732-B | Pharmaceutical compound for treating liver diseases and application thereof | 江苏新元素医药科技有限公司 | 2021-10-26 | — | — | CN | disclosed |
| WO-2020035058-A1 | PHARMACEUTICAL COMPOUNDS FOR TREATING LIVER DISEASES AND APPLICATION THEREOF | 江苏新元素医药科技有限公司 | 2020-02-20 | — | — | WO | disclosed |
| WO-2020035058-A1 | PHARMACEUTICAL COMPOUNDS FOR TREATING LIVER DISEASES AND APPLICATION THEREOF | 江苏新元素医药科技有限公司 | 2020-02-20 | — | — | WO | disclosed |
| CN-110294732-A | Medical compounds and its application for treating hepatopathy | 江苏新元素医药科技有限公司 | 2019-10-01 | — | — | CN | disclosed |