Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | CISD2 | Q8N5K1 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GRM6 | O15303 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CASP3 | P42574 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.30 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.30 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.30 |
| ▸ | IKBKB | O14920 | 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 | |
|---|---|---|---|---|
| SCHEMBL5839757 | 0.78 | KEAP1 (0.41) | GAAOPRD1KEAP1NFE2L2ALDH1A1 | |
| SCHEMBL6920646 | 0.73 | ALDH1A1 (0.40) | OPRD1KEAP1NFE2L2ALDH1A1KDM4E | |
| SCHEMBL7836963 | 0.71 | KEAP1 (0.57) | KEAP1NFE2L2ALDH1A1KDM4EMAPT | |
| SCHEMBL6921023 | 0.68 | CSNK2A2 (0.38) | GAAOPRD1KEAP1NFE2L2CISD2 | |
| SCHEMBL7983631 | 0.66 | ALDH1A1 (0.33) | OPRD1KEAP1NFE2L2ALDH1A1KDM4E | |
| SCHEMBL6925163 | 0.66 | KEAP1 (0.47) | GAAOPRD1KEAP1NFE2L2ALDH1A1 | |
| SCHEMBL6921024 | 0.63 | HPGD (0.39) | GAAOPRD1KEAP1NFE2L2ALDH1A1 | |
| SCHEMBL6926946 | 0.62 | KMT2A (0.52) | GAACISD2NPC1MAPTRAB9A | |
| SCHEMBL1417353 | 0.62 | CSNK2A2 (0.45) | GAAOPRD1ALDH1A1KDM4ENPC1 | |
| SCHEMBL3239031 | 0.62 | KDM4E (0.54) | GAAOPRD1ALDH1A1KDM4ENPC1 |
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-6562840-B1 | Non-peptidic inhibitors of proteolytic enzymes such as urokinase | 3-DIMENSIONAL PHARMACEUTICALS, INC. | 2003-05-13 | — | — | US | disclosed |