Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 1/20 | 0.45 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.45 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.40 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.33 |
| ▸ | SELE | P16581 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA9 | Q16790 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30423970 | 0.84 | ALDH1A1 (0.48) | GSTP1GSTM2SMN1; SMN2 | |
| SCHEMBL4082004 | 0.80 | GSTP1 (0.49) | GSTP1GSTM2TGFBR1P2RX3CCNA2 | |
| SCHEMBL26186317 | 0.79 | HDAC1 (0.48) | GSTP1GSTM2TGFBR1P2RX3CCNA2 | |
| SCHEMBL23500769 | 0.79 | MEN1 (0.54) | GSTP1GSTM2TGFBR1P2RX3CCNA2 | |
| SCHEMBL21471527 | 0.79 | GSTP1 (0.51) | GSTP1GSTM2TGFBR1P2RX3CCNA2 | |
| SCHEMBL28409562 | 0.79 | GSTP1 (0.51) | GSTP1GSTM2TGFBR1P2RX3CCNA2 | |
| SCHEMBL15341327 | 0.79 | ALDH1A1 (0.42) | GSTP1GSTM2TGFBR1P2RX3SMN1; SMN2 | |
| SCHEMBL23500569 | 0.77 | ALDH1A1 (0.51) | GSTP1GSTM2P2RX3MEN1KMT2A | |
| SCHEMBL31418006 | 0.76 | GSTP1 (0.41) | GSTP1GSTM2TGFBR1P2RX3CCNA2 | |
| SCHEMBL8237785 | 0.76 | HDAC6 (0.43) | GSTP1GSTM2TGFBR1P2RX3SMN1; SMN2 |
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-113735830-B | Hydroxamic acid derivative and application thereof | 成都自豪药业有限公司 | 2024-08-20 | — | — | CN | disclosed |
| CN-117384124-A | HDAC inhibitors, compositions and uses thereof | 安徽中医药大学 | 2024-01-12 | — | — | CN | disclosed |