Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FBP1 | P09467 | 2/20 | 0.46 |
| ▸ | CRHBP | P24387 | 2/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | TLR4 | O00206 | 2/20 | 0.40 |
| ▸ | TLR2 | O60603 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2574578 | 1.00 | FBP1 (0.46) | FBP1CRHBPCRHR2ALDH1A1SMN1; SMN2 | |
| SCHEMBL7671902 | 0.80 | VCP (0.50) | MAPTHTTCYP1A2CYP2D6TLR4 | |
| SCHEMBL2572405 | 0.78 | CRHBP (0.43) | FBP1CRHBPCRHR2ALDH1A1CYP1A2 | |
| SCHEMBL2572406 | 0.78 | CRHBP (0.43) | FBP1CRHBPCRHR2ALDH1A1CYP1A2 | |
| SCHEMBL3890228 | 0.71 | MAOB (0.56) | FBP1ALDH1A1SMN1; SMN2MAPTMEN1 | |
| SCHEMBL8627948 | 0.71 | MAOB (0.56) | FBP1ALDH1A1SMN1; SMN2MAPTMEN1 | |
| SCHEMBL15093965 | 0.71 | MAOB (0.56) | FBP1ALDH1A1SMN1; SMN2MAPTMEN1 | |
| SCHEMBL8781469 | 0.70 | CRHBP (0.47) | CRHBPCRHR2ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL9265192 | 0.70 | CRHBP (0.47) | CRHBPCRHR2ALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL28831619 | 0.69 | NPC1 (0.53) | ALDH1A1SMN1; SMN2MAPTKMT2ACYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2385034-A2 | Process for the preparation of 1-nitro-4-oxobutanylamides | Synkola, s.r.o. (SK) | 2011-11-09 | — | — | EP | disclosed |