Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | PAK4 | O96013 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | RET | P07949 | 1/20 | 0.40 |
| ▸ | IGF1R | P08069 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 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 | |
|---|---|---|---|---|
| SCHEMBL17789217 | 0.94 | ACHE (0.46) | ACHEALDH1A1CYP3A4CASP1RECQL | |
| SCHEMBL18976832 | 0.89 | ACHE (0.46) | ACHEALDH1A1CYP3A4TDP1SMN1; SMN2 | |
| SCHEMBL23567922 | 0.87 | CYP3A4 (0.48) | CDK5CHEK1AURKADAPK3JAK2 | |
| SCHEMBL807465 | 0.87 | CYP3A4 (0.48) | CDK5CHEK1AURKADAPK3JAK2 | |
| SCHEMBL29636243 | 0.87 | CYP3A4 (0.48) | CDK5CHEK1AURKADAPK3JAK2 | |
| SCHEMBL29549133 | 0.87 | CYP3A4 (0.48) | CDK5CHEK1AURKADAPK3JAK2 | |
| SCHEMBL18682060 | 0.80 | CYP3A4 (0.47) | ACHECDK5CHEK1AURKADAPK3 | |
| SCHEMBL10070929 | 0.80 | CYP3A4 (0.47) | ACHECDK5CHEK1AURKADAPK3 | |
| SCHEMBL17678877 | 0.79 | ALDH1A1 (0.54) | CDK5CHEK1AURKADAPK3JAK2 | |
| SCHEMBL22087616 | 0.73 | ACHE (0.60) | ACHEALDH1A1CYP3A4CASP1RECQL |
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 |
|---|---|---|---|---|---|---|---|
| US-9751985-B2 | Triptycene-based dianhydrides, polyimides, methods of making each, and methods of use | KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) | 2017-09-05 | — | — | US | disclosed |