Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLO1 | Q04760 | 5/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CTPS1 | P17812 | 3/20 | 0.36 |
| ▸ | CKS1B | P61024 | 2/20 | 0.35 |
| ▸ | SKP2 | Q13309 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 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 | |
|---|---|---|---|---|
| SCHEMBL20674553 | 0.82 | GLO1 (0.54) | GLO1HTTALOX15CKS1BSKP2 | |
| SCHEMBL21955927 | 0.76 | ALOX15 (0.36) | GLO1HTTALOX15CTPS1CKS1B | |
| SCHEMBL20674552 | 0.71 | MEN1 (0.47) | ALOX15LMNAALDH1A1TDP1POLB | |
| SCHEMBL5007530 | 0.67 | CA1 (0.54) | GLO1HTTALOX15CTPS1LMNA | |
| SCHEMBL20674171 | 0.64 | COMT (0.41) | GLO1HTTALOX15MAPTGAA | |
| SCHEMBL20674167 | 0.62 | EP300 (0.50) | HPGDGAA | |
| SCHEMBL20674168 | 0.61 | COMT (0.39) | GLO1HTTALOX15ALDH1A1MAPT | |
| SCHEMBL20674186 | 0.61 | FTO (0.56) | GLO1ALDH1A1TDP1MAPTSLC40A1 | |
| SCHEMBL20674489 | 0.61 | GLO1 (0.47) | GLO1HTTALOX15CKS1BSKP2 | |
| SCHEMBL6862410 | 0.60 | GLO1 (1.00) | GLO1HTTALOX15CKS1BSKP2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3399968-B1 | SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE | CS PHARMATECH LTD (KY) | 2021-10-20 | — | — | EP | disclosed |