Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.36 |
| ▸ | FYN | P06241 | 3/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | LDHA | P00338 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27943632 | 0.75 | — | — | |
| SCHEMBL30141205 | 0.75 | — | — | |
| SCHEMBL30589056 | 0.74 | — | — | |
| SCHEMBL28301107 | 0.68 | — | — | |
| SCHEMBL17365662 | 0.67 | CYP1A2 (0.53) | HCAR3CYP1A2ALOX15CLK4CYP3A4 | |
| SCHEMBL15382063 | 0.67 | HCAR3 (0.50) | HCAR3CYP1A2ALOX15CLK4CYP3A4 | |
| SCHEMBL2321199 | 0.67 | ALDH1A1 (0.50) | HCAR3CYP1A2ALOX15CLK4CYP3A4 | |
| SCHEMBL24284200 | 0.66 | HCAR3 (0.49) | HCAR3CYP1A2ALOX15CLK4CYP3A4 | |
| SCHEMBL970114 | 0.66 | HCAR3 (0.45) | HCAR3CYP1A2ALOX15CLK4CYP3A4 | |
| SCHEMBL2645239 | 0.66 | HCAR3 (0.49) | HCAR3CYP1A2ALOX15CLK4CYP3A4 |
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-107304191-B | Indolylamine 2,3-dioxygenase inhibitor and preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2023-09-29 | — | — | CN | disclosed |
| CN-107304191-A | Indoleamine 2,3 dioxygenase inhibitors and preparation method and application | 上海翰森生物医药科技有限公司 | 2017-10-31 | — | — | CN | disclosed |