Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.65 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.65 |
| ▸ | TRPV1 | Q8NER1 | 9/20 | 0.64 |
| ▸ | NPC1 | O15118 | 2/20 | 0.64 |
| ▸ | RAB9A | P51151 | 2/20 | 0.64 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.59 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.58 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.58 |
| ▸ | PPARD | Q03181 | 1/20 | 0.58 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.56 |
| ▸ | MLYCD | O95822 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11758459 | 1.00 | HDAC3 (0.65) | HDAC3HDAC1TRPV1NPC1RAB9A | |
| SCHEMBL11761056 | 1.00 | HDAC3 (0.65) | HDAC3HDAC1TRPV1NPC1RAB9A | |
| SCHEMBL11762085 | 1.00 | HDAC3 (0.65) | HDAC3HDAC1TRPV1NPC1RAB9A | |
| SCHEMBL11753468 | 1.00 | HDAC3 (0.65) | HDAC3HDAC1TRPV1NPC1RAB9A | |
| SCHEMBL11758482 | 1.00 | HDAC3 (0.65) | HDAC3HDAC1TRPV1NPC1RAB9A | |
| SCHEMBL11762106 | 1.00 | HDAC3 (0.65) | HDAC3HDAC1TRPV1NPC1RAB9A | |
| SCHEMBL11761331 | 1.00 | HDAC3 (0.65) | HDAC3HDAC1TRPV1NPC1RAB9A | |
| SCHEMBL11759668 | 0.94 | TRPV1 (0.62) | HDAC3HDAC1TRPV1NPC1RAB9A | |
| SCHEMBL11755757 | 0.94 | HDAC3 (0.66) | HDAC3HDAC1TRPV1NPC1RAB9A | |
| SCHEMBL11759016 | 0.94 | TRPV1 (0.63) | HDAC3HDAC1TRPV1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-4009208-A | N,N'-HEPTAMETHYLENEBIS(4-METHOXYBENZAMIDE) | STERLING DRUG INC. (US) | 1977-02-22 | — | — | US | disclosed |
| US-3869443-A | N,N{40 -Heptamethylenebis(4-trifluoromethoxybenzamide)-{62 -cyclodextrin inclusion complex | STERLING DRUG INC | 1975-03-04 | — | — | US | disclosed |