Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.58 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.58 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.58 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.58 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.58 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.58 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.58 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | LMNA | P02545 | 4/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | MAOB | P27338 | 7/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9211616 | 1.00 | NPC1 (0.58) | NPC1TSHRHDAC3HDAC4HDAC1 | |
| SCHEMBL14646639 | 0.87 | HDAC3 (0.56) | NPC1TSHRHDAC3HDAC4HDAC1 | |
| SCHEMBL6047363 | 0.86 | NPC1 (0.72) | NPC1TSHRHDAC3HDAC4HDAC1 | |
| SCHEMBL6047364 | 0.86 | NPC1 (0.72) | NPC1TSHRHDAC3HDAC4HDAC1 | |
| SCHEMBL22951391 | 0.86 | NPC1 (0.72) | NPC1TSHRHDAC3HDAC4HDAC1 | |
| SCHEMBL4780407 | 0.80 | HDAC3 (0.56) | NPC1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL1372519 | 0.80 | HDAC3 (0.56) | NPC1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL1372517 | 0.80 | HDAC3 (0.56) | NPC1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4780413 | 0.80 | HDAC3 (0.56) | NPC1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL15929620 | 0.80 | HDAC8 (0.60) | NPC1HDAC3HDAC4HDAC1HDAC7 |
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 |
|---|---|---|---|---|---|---|---|
| JP-7017892-A | — | — | None | — | — | JP | disclosed |
| JP-H0717892-A | 1,3-BUTADIENYL KETONE DERIVATIVE, ULTRAVIOLET RAY ABSORBER AND SKIN EXTERNAL PREPARATION CONTAINING THE SAME BLENDED THEREIN | SHISEIDO CO LTD | 1995-01-20 | — | — | JP | disclosed |