Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.35 |
| ▸ | IAPP | P10997 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16728497 | 0.89 | TDP1 (0.45) | TDP1ALDH1A1FFAR3IAPPMEN1 | |
| SCHEMBL16725017 | 0.80 | TDP1 (0.47) | TDP1ALDH1A1FFAR3IAPPCES2 | |
| SCHEMBL12424396 | 0.80 | TDP1 (0.47) | TDP1ALDH1A1FFAR3IAPPCES2 | |
| SCHEMBL840557 | 0.78 | ALDH1A1 (0.45) | TDP1ALDH1A1FFAR3IAPP | |
| SCHEMBL4257794 | 0.78 | TDP1 (0.45) | TDP1ALDH1A1FFAR3IAPPCES2 | |
| SCHEMBL619312 | 0.77 | TDP1 (0.69) | TDP1ALDH1A1FFAR3IAPPCES2 | |
| SCHEMBL8895768 | 0.76 | FAAH (0.35) | TDP1ALDH1A1CES2CES1MEN1 | |
| SCHEMBL21078338 | 0.76 | TDP1 (0.43) | TDP1ALDH1A1FFAR3IAPPCES2 | |
| SCHEMBL27511799 | 0.76 | TDP1 (0.43) | TDP1ALDH1A1FFAR3IAPPMEN1 | |
| SCHEMBL17481554 | 0.74 | ACLY (0.42) | TDP1ALDH1A1FFAR3SMN1; SMN2HDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118344262-A | Aliphatic synthetic tanning agent containing multifunctional structure and preparation method thereof | 南京工业大学 | 2024-07-16 | — | — | CN | disclosed |