Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.33 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.31 |
| ▸ | CASP6 | P55212 | 1/20 | 0.30 |
| ▸ | GRK6 | P43250 | 1/20 | 0.30 |
| ▸ | DCUN1D1 | Q96GG9 | 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 | |
|---|---|---|---|---|
| SCHEMBL13454727 | 0.74 | PDE3B (0.42) | KDM4EALDH1A1 | |
| SCHEMBL15650433 | 0.70 | KDM4E (0.35) | ADORA3ADORA2AADORA1KDM4EALDH1A1 | |
| SCHEMBL3364506 | 0.69 | BACE1 (0.44) | KDM4EDCUN1D1 | |
| SCHEMBL13724990 | 0.69 | CYP3A4 (0.38) | KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL27242624 | 0.69 | SMN1; SMN2 (0.37) | KDM4EALDH1A1L3MBTL1DCUN1D1 | |
| SCHEMBL25081553 | 0.69 | KDM4E (0.36) | ADORA3ADORA2AADORA1KDM4EALDH1A1 | |
| SCHEMBL21672119 | 0.69 | CA2 (0.39) | ALDH1A1NPSR1 | |
| SCHEMBL27710164 | 0.69 | MAPT (0.47) | KDM4EALDH1A1KDM1AL3MBTL1 | |
| SCHEMBL18368347 | 0.69 | LMNA (0.40) | KDM4EALDH1A1KDM1A | |
| SCHEMBL3073140 | 0.68 | KDM4E (0.54) | ADORA2AADORA1KDM4EALDH1A1NPSR1 |
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-2021000885-A1 | QUINAZOLINE DERIVATIVES, PREPARATION PROCESS AND MEDICAL USE THEREOF | 江苏恒瑞医药股份有限公司 | 2021-01-07 | — | — | WO | disclosed |