Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
| ▸ | COMT | P21964 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL29861403 | 0.81 | HSD17B10 (0.33) | SLC22A12CYP1A2HSD17B10TSHRCYP2C9 | |
| SCHEMBL23326642 | 0.81 | EGFR (0.35) | SLC22A12CYP1A2HSD17B10TSHRCYP2C9 | |
| SCHEMBL29861884 | 0.81 | EGFR (0.35) | SLC22A12CYP1A2HSD17B10TSHRCYP2C9 | |
| SCHEMBL23326744 | 0.81 | HSD17B10 (0.33) | SLC22A12CYP1A2HSD17B10TSHRCYP2C9 | |
| SCHEMBL13167052 | 0.74 | KDM4E (0.42) | SLC22A12HPGDALDH1A1MAPTRXFP1 | |
| SCHEMBL31516455 | 0.74 | KDM4E (0.42) | SLC22A12HPGDALDH1A1MAPTRXFP1 | |
| SCHEMBL12410481 | 0.74 | SELE (0.35) | SLC22A12HSD17B10HPGDHTTALDH1A1 | |
| SCHEMBL3560749 | 0.73 | KDM4E (0.41) | SLC22A12HPGDALDH1A1MAPTRXFP1 | |
| SCHEMBL17148436 | 0.73 | SELE (0.34) | SLC22A12ALDH1A1SRCSELEVCAM1 | |
| SCHEMBL5560155 | 0.73 | ADORA2A (0.35) | SLC22A12HTTALDH1A1SRCMAPT |
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-2022170802-A1 | PYRIMIDO-PYRIDONE DERIVATIVE AS SOS1 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 苏州阿尔脉生物科技有限公司 | 2022-08-18 | — | — | WO | disclosed |