Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 8/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 7/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.53 |
| ▸ | HDAC7 | Q8WUI4 | 7/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 7/20 | 0.53 |
| ▸ | HDAC10 | Q969S8 | 7/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 7/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.53 |
| ▸ | HDAC9 | Q9UKV0 | 7/20 | 0.53 |
| ▸ | HDAC5 | Q9UQL6 | 7/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL18985266 | 0.87 | HDAC8 (0.56) | HDAC8HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL18985292 | 0.83 | HDAC8 (0.54) | HDAC8HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL19003361 | 0.75 | NAMPT (0.52) | HDAC8HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL19003360 | 0.72 | HDAC1 (0.46) | HDAC8HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL19003461 | 0.70 | EGFR (0.54) | HDAC8NPC1RAB9AMEN1KMT2A | |
| SCHEMBL24702461 | 0.69 | HDAC3 (0.45) | HDAC8HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL20766426 | 0.68 | FAAH (0.70) | POLBNPC1RAB9ARECQLLMNA | |
| SCHEMBL18985229 | 0.68 | ACACB (0.50) | POLBNPC1RAB9ACYP3A4SMN1; SMN2 | |
| SCHEMBL19003308 | 0.68 | EGFR (0.54) | HDAC8NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL16055827 | 0.68 | CYP3A4 (0.55) | HDAC8HDAC3HDAC4HDAC1HDAC7 |
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 3 patents. 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 | claimed |
| WO-2017102014-A1 | PROPENAMIDE THIOPHENE DERIVATIVES AS FLAVIVIRUS INHIBITORS AND THEIR USE | UNIVERSITE D'AIX-MARSEILLE (FR) | 2017-06-22 | — | — | WO | disclosed |
| WO-2017102014-A1 | PROPENAMIDE THIOPHENE DERIVATIVES AS FLAVIVIRUS INHIBITORS AND THEIR USE | UNIVERSITE D'AIX-MARSEILLE (FR) | 2017-06-22 | — | — | WO | disclosed |