Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCQ | Q04759 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 4/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CFB | P00751 | 2/20 | 0.31 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22817320 | 0.84 | KARS1 (0.35) | PRKCQHTTHRH3GRM5CHRNA7 | |
| SCHEMBL4484912 | 0.70 | AHR (0.47) | GRM5CFB | |
| SCHEMBL24728224 | 0.70 | NR3C1 (0.34) | MAPTCHRNA7ALDH1A1CHEK1 | |
| SCHEMBL4798726 | 0.68 | CYP1A2 (0.40) | MAPTCYP1A2GRM5CFB | |
| SCHEMBL1669581 | 0.67 | MAPT (0.43) | PRKCQMAPTCYP1A2ALDH1A1CFB | |
| SCHEMBL18299986 | 0.66 | KIF11 (0.38) | — | |
| SCHEMBL14526754 | 0.66 | REN (0.38) | CYP1A2GRM5CFB | |
| SCHEMBL27765395 | 0.66 | RAPGEF4 (0.48) | PRKCQ | |
| SCHEMBL24728147 | 0.66 | ZAP70 (0.32) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL2983533 | 0.65 | ALDH1A1 (0.38) | GRM5ALDH1A1CFB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020257495-A1 | INHIBITORS OF ERYTHROCYTE BAND 3 TYROSINE PHOSPHORYLATION AND USES THEREOF | PURDUE RESEARCH FOUNDATION (US) | 2020-12-24 | — | — | WO | disclosed |