Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 1/20 | 0.38 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | PRNP | P04156 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.32 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.32 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TNF | P01375 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30320915 | 0.80 | GSTP1 (0.40) | GSTP1GSTM2POLBKMT2APRNP | |
| SCHEMBL29069652 | 0.80 | GSTP1 (0.40) | GSTP1GSTM2POLBKMT2APRNP | |
| SCHEMBL30320927 | 0.76 | GSTP1 (0.41) | GSTP1GSTM2POLBKMT2APRNP | |
| SCHEMBL29069624 | 0.76 | GSTP1 (0.41) | GSTP1GSTM2POLBKMT2APRNP | |
| SCHEMBL30424105 | 0.72 | GSTP1 (0.41) | GSTP1GSTM2POLBKMT2ARXFP1 | |
| SCHEMBL29069633 | 0.72 | GSTP1 (0.41) | GSTP1GSTM2POLBKMT2ARXFP1 | |
| SCHEMBL30321002 | 0.71 | GSTP1 (0.39) | GSTP1GSTM2POLBKMT2APRNP | |
| SCHEMBL29069631 | 0.71 | GSTP1 (0.39) | GSTP1GSTM2POLBKMT2APRNP | |
| SCHEMBL29069650 | 0.71 | GSTP1 (0.41) | GSTP1GSTM2POLBKMT2APRNP | |
| SCHEMBL3574517 | 0.70 | ALDH1A1 (0.39) | POLBKMT2AHPGDMAPTHSD17B10 |
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-2023046198-A1 | SULFA KETONE COMPOUNDS, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF | 中国医药研究开发中心有限公司 | 2023-03-30 | — | — | WO | disclosed |