Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM3 | Q86V86 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.36 |
| ▸ | FLT1 | P17948 | 1/20 | 0.36 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | GALR2 | O43603 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | TPMT | P51580 | 1/20 | 0.34 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24241501 | 1.00 | PIM3 (0.38) | PIM3ALDH1A1VCAM1MAPTKDM4E | |
| SCHEMBL29060280 | 0.85 | MAPT (0.39) | PIM3ALDH1A1VCAM1MAPTKDM4E | |
| SCHEMBL29662676 | 0.80 | NPSR1 (0.41) | PIM3VCAM1MAPTKDM4ENPSR1 | |
| SCHEMBL29060253 | 0.80 | NPSR1 (0.41) | PIM3VCAM1MAPTKDM4ENPSR1 | |
| SCHEMBL24241054 | 0.78 | AR (0.43) | PIM3ALDH1A1KDM4ELMNAMAPK1 | |
| SCHEMBL29379156 | 0.78 | AR (0.43) | PIM3ALDH1A1KDM4ELMNAMAPK1 | |
| SCHEMBL24241258 | 0.75 | POLB (0.33) | PIM3ALDH1A1MAPTKDM4EPDGFRB | |
| SCHEMBL24779889 | 0.74 | PDGFRB (0.45) | PIM3ALDH1A1VCAM1MAPTKDM4E | |
| SCHEMBL30792063 | 0.73 | KMT2A (0.48) | ALDH1A1VCAM1MAPTKDM4ENPSR1 | |
| SCHEMBL29625012 | 0.71 | VCAM1 (0.55) | ALDH1A1VCAM1NPSR1ERN1POLB |
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-116670140-A | Macrocyclic compounds containing 1,3, 4-oxadiazole rings as modulators of cystic fibrosis transmembrane conductance regulator | 弗特克斯药品有限公司 | 2023-08-29 | — | — | CN | disclosed |
| CN-116171154-A | Modulators of cystic fibrosis transmembrane conductance regulator | 弗特克斯药品有限公司 | 2023-05-26 | — | — | CN | disclosed |