Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 2/20 | 0.47 |
| ▸ | KDM1A | O60341 | 5/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.37 |
| ▸ | SMARCA2 | P51531 | 2/20 | 0.37 |
| ▸ | SMARCA4 | P51532 | 2/20 | 0.37 |
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL28132393 | 0.78 | CYP2D6 (0.44) | MEN1MAPTKMT2ALMNACYP1A2 | |
| SCHEMBL15006764 | 0.75 | ASIC3 (0.53) | MAOBMEN1MAPTKMT2ASMN1; SMN2 | |
| SCHEMBL28458373 | 0.75 | HTR2B (0.49) | HTR2BKDM1AIDO1HDAC1HDAC2 | |
| SCHEMBL6674627 | 0.74 | SMN1; SMN2 (0.60) | IDO1NR1I2SMARCA2SMARCA4PBRM1 | |
| SCHEMBL1444761 | 0.74 | MIF (0.56) | KDM1AIDO1NR1I2SMARCA2SMARCA4 | |
| SCHEMBL27871811 | 0.74 | HPGD (0.45) | KDM1AIDO1NR1I2SMARCA2SMARCA4 | |
| SCHEMBL22402524 | 0.72 | HTR2B (0.54) | HTR2BIDO1NR1I2SMARCA2SMARCA4 | |
| SCHEMBL20705126 | 0.70 | SMARCA2 (0.47) | KDM1AIDO1SMARCA2SMARCA4MEN1 | |
| Formic Acid SCHEMBL21411987 | 0.70 | CASP6 (0.40) | HTR2BKDM1AIDO1HDAC1HDAC2 | |
| SCHEMBL304034 | 0.69 | ALDH1A1 (0.41) | MEN1MAPTKMT2AHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-106496130-B | A kind of methyl ketone derivatives and the preparation method and application thereof | 苏州大学 | 2019-09-20 | — | — | CN | disclosed |
| CN-106496130-A | A kind of methyl ketone derivatives and preparation method and application | 苏州大学 | 2017-03-15 | — | — | CN | disclosed |