Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28706584 | 0.87 | CASP3 (0.39) | CASP3CASP7FFAR4TAAR1ADORA2A | |
| SCHEMBL28719784 | 0.87 | KDM4E (0.47) | CASP3CASP7FFAR4ADORA2APOLB | |
| SCHEMBL28709459 | 0.86 | ICMT (0.41) | CASP3CASP7HDAC1HDAC6HDAC3 | |
| SCHEMBL28709464 | 0.85 | HDAC1 (0.43) | FFAR4TAAR1HDAC1HDAC6HDAC3 | |
| SCHEMBL29425667 | 0.85 | HDAC1 (0.43) | FFAR4TAAR1HDAC1HDAC6HDAC3 | |
| SCHEMBL28713377 | 0.84 | ALDH1A1 (0.47) | CASP3ADORA2AHDAC6HDAC2HDAC8 | |
| SCHEMBL28700875 | 0.80 | CYP1A2 (0.47) | HDAC1HDAC6HDAC3HDAC2HDAC10 | |
| SCHEMBL29425677 | 0.78 | KMT2A (0.48) | LMNAMEN1KMT2AHTTSMN1; SMN2 | |
| SCHEMBL28716489 | 0.78 | KMT2A (0.48) | LMNAMEN1KMT2AHTTSMN1; SMN2 | |
| SCHEMBL28715740 | 0.76 | ALDH1A1 (0.45) | POLBMEN1ALDH1A1KMT2AHTT |
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-114213307-A | Preparation method of N-alkyl substituted pyrrolidone compound | 河南农业大学 | 2022-03-22 | — | — | CN | disclosed |