Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 8/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | USP28 | Q96RU2 | 1/20 | 0.30 |
| ▸ | AGXT | P21549 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | ALPL | P05186 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL25414993 | 0.98 | DPP4 (0.41) | DPP4MAPTALDH1A1GAAIDO1 | |
| SCHEMBL8337555 | 0.75 | DPP4 (0.42) | DPP4 | |
| SCHEMBL23159231 | 0.75 | DPP4 (0.42) | DPP4MAPTALDH1A1GAAIDO1 | |
| SCHEMBL1757600 | 0.75 | IDO1 (0.53) | ALDH1A1GAAIDO1ADRA2BAGXT | |
| SCHEMBL25413739 | 0.73 | GAA (0.46) | DPP4MAPTALDH1A1GAAIDO1 | |
| SCHEMBL8223792 | 0.73 | MEN1 (0.42) | MAPTALDH1A1IDO1CYP3A4CYP1A2 | |
| Hydrochloric Acid SCHEMBL21332846 | 0.73 | IDO1 (0.55) | MAPTALDH1A1GAAIDO1ADRA2B | |
| Hydrochloric Acid SCHEMBL15065821 | 0.73 | IDO1 (0.55) | MAPTALDH1A1GAAIDO1ADRA2B | |
| SCHEMBL3139434 | 0.73 | USP28 (0.39) | DPP4USP28 | |
| Hydrochloric Acid SCHEMBL15065772 | 0.73 | ALDH1A1 (0.44) | DPP4MAPTALDH1A1GAAIDO1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022258052-A1 | HETEROCYCLIC LACTAM COMPOUND, AND PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF | 劲方医药科技(上海)有限公司 | 2022-12-15 | — | — | WO | disclosed |