Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL959122 | 0.81 | ALDH1A1 (0.50) | CHRM2ALDH1A1KDM4EHPGDCA1 | |
| SCHEMBL2663601 | 0.80 | CYP1B1 (0.48) | ALDH1A1KDM4ECYP3A4GAAHPGD | |
| SCHEMBL4093992 | 0.80 | ALDH1A1 (0.63) | ALDH1A1GAACYP1B1ACHECASP1 | |
| SCHEMBL4484872 | 0.80 | CYP1B1 (0.48) | ALDH1A1KDM4EHPGDCYP1B1ACHE | |
| SCHEMBL13903462 | 0.78 | CHRM2 (0.57) | CHRM2CA1CA2CA9CA12 | |
| SCHEMBL1581709 | 0.78 | CYP1B1 (0.59) | ALDH1A1KDM4ECYP3A4GAAHPGD | |
| SCHEMBL18688563 | 0.78 | ALDH1A1 (0.72) | ALDH1A1KDM4EGAAHPGDPOLB | |
| SCHEMBL10054041 | 0.77 | POLB (0.59) | CHRM2ALDH1A1GAACYP1B1CA1 | |
| SCHEMBL6840053 | 0.76 | HTR2A (0.56) | ALDH1A1KDM4EHPGD | |
| SCHEMBL10491309 | 0.76 | POLB (0.63) | ALDH1A1GAAHPGDCA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017049409-A1 | COMPOSITIONS FOR PROMOTING READTHROUGH OF PREMATURE TERMINATION CODONS, AND METHODS OF USING THE SAME | THE CENTRE FOR DRUG RESEARCH AND DEVELOPMENT (CA) | 2017-03-30 | — | — | WO | disclosed |
| WO-2002040445-A1 | GLUCAGON ANTAGONISTS/INVERSE AGONISTS | NOVO NORDISK A/S (DK) | 2002-05-23 | — | — | WO | disclosed |