Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | STAT3 | P40763 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28293343 | 0.74 | SMN1; SMN2 (0.39) | LMNAKDM4ENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL152858 | 0.73 | ABL1 (0.34) | — | |
| SCHEMBL16418610 | 0.69 | GAA (0.32) | NPC1RAB9A | |
| SCHEMBL28291731 | 0.68 | SMN1; SMN2 (0.46) | NPC1RAB9ASMN1; SMN2POLBALDH1A1 | |
| SCHEMBL28291722 | 0.67 | KMT2A (0.41) | KDM4ENPC1RAB9ASMN1; SMN2KMT2A | |
| SCHEMBL15877470 | 0.67 | CYP2C19 (0.38) | LMNAKDM4ENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL30884998 | 0.67 | TSHR (0.42) | KDM4ESMN1; SMN2ALDH1A1KMT2ATSHR | |
| SCHEMBL28291728 | 0.67 | NPSR1 (0.41) | LMNAKDM4ERAB9ASMN1; SMN2POLB | |
| SCHEMBL16790113 | 0.67 | DGAT1 (0.47) | AAK1 | |
| SCHEMBL14244584 | 0.66 | — | — |
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-109608390-B | Synthesis method of chiral quaternary carbon pyridine beta-hydroxy ester compound | 温州大学 | 2022-03-25 | — | — | CN | disclosed |
| CN-109608390-A | A kind of synthetic method of chirality quaternary carbon pyridines β hydroxyl esters compound | 温州大学 | 2019-04-12 | — | — | CN | disclosed |