Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | MME | P08473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11920606 | 0.85 | SMN1; SMN2 (0.47) | MEN1GAAKMT2ASMN1; SMN2KDM4E | |
| SCHEMBL20825353 | 0.84 | MEN1 (0.44) | MEN1GAAKMT2ASMN1; SMN2 | |
| SCHEMBL19357459 | 0.81 | SMN1; SMN2 (0.45) | MEN1GAAKMT2ASMN1; SMN2ADRA1A | |
| SCHEMBL625405 | 0.79 | SMN1; SMN2 (0.45) | MEN1GAAKMT2ASMN1; SMN2ADRA1A | |
| SCHEMBL28272471 | 0.75 | OPRM1 (0.39) | — | |
| SCHEMBL19031287 | 0.75 | HDAC4 (0.43) | MEN1GAAKMT2ASMN1; SMN2KDM4E | |
| SCHEMBL364956 | 0.75 | SLC6A4 (0.49) | GAASMN1; SMN2KDM4ELMNAGRIN1 | |
| SCHEMBL28272416 | 0.74 | OPRM1 (0.40) | — | |
| SCHEMBL3621860 | 0.73 | SMN1; SMN2 (0.42) | MEN1GAAKMT2ASMN1; SMN2KDM4E | |
| SCHEMBL10695508 | 0.73 | OPRM1 (0.48) | SMN1; SMN2KDM4EHSD11B1LMNACASP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011061590-A1 | NOVEL CARBOXAMIDE DERIVATIVES AS HIV INHIBITORS | HETERO RESEARCH FOUNDATION (IN) | 2011-05-26 | — | — | WO | disclosed |
| WO-2011061590-A1 | NOVEL CARBOXAMIDE DERIVATIVES AS HIV INHIBITORS | HETERO RESEARCH FOUNDATION (IN) | 2011-05-26 | — | — | WO | disclosed |