Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | CES2 | O00748 | 3/20 | 0.38 |
| ▸ | CES1 | P23141 | 3/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6384300 | 0.79 | MAPT (0.45) | ALDH1A1TDP1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL3871767 | 0.78 | MAPT (0.44) | ALDH1A1TDP1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL4516672 | 0.76 | TSHR (0.43) | ALDH1A1TDP1SMN1; SMN2LMNANPSR1 | |
| SCHEMBL6605322 | 0.74 | TDP1 (0.45) | ALDH1A1TDP1MAPK1SMN1; SMN2LMNA | |
| SCHEMBL6601283 | 0.73 | PGR (0.44) | ALDH1A1TDP1MAPK1SMN1; SMN2LMNA | |
| SCHEMBL8051024 | 0.71 | MAPT (0.41) | ALDH1A1TDP1MAPK1SMN1; SMN2LMNA | |
| SCHEMBL6383659 | 0.70 | NPC1 (0.43) | ALDH1A1SMN1; SMN2LMNANPSR1MAPT | |
| Acetophenone SCHEMBL28366768 | 0.69 | SMN1; SMN2 (0.54) | ALDH1A1TDP1MAPK1SMN1; SMN2LMNA | |
| Benzoic Acid SCHEMBL28308126 | 0.69 | TSHR (0.61) | ALDH1A1TDP1MAPK1SMN1; SMN2LMNA | |
| SCHEMBL5224169 | 0.69 | PGR (0.48) | ALDH1A1TDP1MAPK1SMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003028762-A1 | NOVEL ANTIMICROBIAL RESISTANCE BLOCKING COMPOSITIONS | ETHICON, INC. (US) | 2003-04-10 | — | — | WO | claimed |
| WO-2003028762-A1 | NOVEL ANTIMICROBIAL RESISTANCE BLOCKING COMPOSITIONS | ETHICON, INC. (US) | 2003-04-10 | — | — | WO | disclosed |