Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 3/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | FPR3 | P25089 | 1/20 | 0.34 |
| ▸ | FPR2 | P25090 | 1/20 | 0.34 |
| ▸ | GLS | O94925 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 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 | |
|---|---|---|---|---|
| SCHEMBL7874778 | 0.75 | HDAC3 (0.48) | EPHX2SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL7868172 | 0.74 | HPGD (0.42) | EPHX2KEAP1NFE2L2HPGDSMN1; SMN2 | |
| SCHEMBL7868121 | 0.73 | MAPK1 (0.50) | KEAP1NFE2L2SMN1; SMN2HDAC3HDAC4 | |
| SCHEMBL5057159 | 0.72 | MAPK1 (0.39) | SMN1; SMN2NPC1RAB9AGAAHDAC3 | |
| SCHEMBL7868159 | 0.70 | SMN1; SMN2 (0.44) | SMN1; SMN2ALDH1A1RAB9A | |
| SCHEMBL7868065 | 0.70 | MAPK1 (0.48) | KEAP1NFE2L2SMN1; SMN2HDAC3HDAC4 | |
| SCHEMBL5240059 | 0.68 | EPHX2 (0.44) | EPHX2HPGDSMN1; SMN2TP53KDM4E | |
| SCHEMBL6056911 | 0.67 | PDE5A (0.46) | EPHX2SMN1; SMN2ALDH1A1NPC1RAB9A | |
| SCHEMBL15680573 | 0.67 | KEAP1 (0.66) | EPHX2KEAP1NFE2L2HPGDSMN1; SMN2 | |
| SCHEMBL7879229 | 0.66 | PIN1 (0.43) | HPGDSMN1; SMN2ALDH1A1TSHRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-6329400-B1 | INHIBITION OR ANTAGONISM OF MATRIX METALLOPROTEASES, AND/OR TUMOR NECROSIS FACTOR-ALPHA; EXTRACELLULAR MATRIX DEGRADATION, INHIBITION OF SHEDDING OF CELL SURFACE PROTEIN ECTODOMAINS AND CD23 PROTEOLYSIS | GLAXO WELLCOME INC. | 2001-12-11 | — | — | US | disclosed |