Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | CA1 | P00915 | 11/20 | 0.53 |
| ▸ | CA2 | P00918 | 11/20 | 0.53 |
| ▸ | CA9 | Q16790 | 7/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | CA12 | O43570 | 5/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.50 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL18985260 | 0.89 | SMN1; SMN2 (0.51) | RAB9ASMN1; SMN2NPC1MAPTMEN1 | |
| SCHEMBL18985262 | 0.89 | SMN1; SMN2 (0.51) | RAB9ASMN1; SMN2NPC1MAPTMEN1 | |
| SCHEMBL18985289 | 0.81 | MAOB (0.64) | RAB9ASMN1; SMN2NPC1MAPTMEN1 | |
| SCHEMBL18985199 | 0.80 | NAMPT (0.48) | RAB9ASMN1; SMN2NPC1MAPTMEN1 | |
| SCHEMBL19003314 | 0.79 | MAOB (0.53) | RAB9ASMN1; SMN2NPC1MAPTMEN1 | |
| SCHEMBL19003456 | 0.78 | MAPT (0.48) | RAB9ASMN1; SMN2NPC1MAPTMEN1 | |
| SCHEMBL18985221 | 0.78 | MEN1 (0.57) | RAB9ASMN1; SMN2NPC1MAPTMEN1 | |
| SCHEMBL18985254 | 0.78 | MEN1 (0.57) | RAB9ASMN1; SMN2NPC1MAPTMEN1 | |
| SCHEMBL19003302 | 0.77 | HSD17B1 (0.48) | RAB9ASMN1; SMN2NPC1MAPTMEN1 | |
| SCHEMBL18985528 | 0.76 | NQO2 (0.56) | RAB9ASMN1; SMN2NPC1MAPTMEN1 |
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-2017102014-A1 | PROPENAMIDE THIOPHENE DERIVATIVES AS FLAVIVIRUS INHIBITORS AND THEIR USE | UNIVERSITE D'AIX-MARSEILLE (FR) | 2017-06-22 | — | — | WO | disclosed |