Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25C | P30307 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.47 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CRHBP | P24387 | 2/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1435066 | 0.89 | CRHBP (0.56) | TSHRKCNH2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL1435064 | 0.89 | CRHBP (0.55) | TSHRKCNH2ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL5401258 | 0.83 | HPGD (0.56) | KCNH2ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27620475 | 0.78 | TSHR (0.68) | TSHRKCNH2ALDH1A1CYP2C19ESR1 | |
| SCHEMBL27531317 | 0.78 | CRHBP (0.50) | TSHRKCNH2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL17258687 | 0.77 | ALDH1A1 (0.51) | PDK2PDK4ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL29668140 | 0.76 | ALDH1A1 (0.53) | CDC25CTSHRKCNH2ALDH1A1CYP1A2 | |
| SCHEMBL7848658 | 0.76 | CDC25C (0.55) | CDC25CTSHRKCNH2ALDH1A1CYP1A2 | |
| SCHEMBL6560450 | 0.75 | CRHBP (0.47) | PDK2PDK4KCNH2ALDH1A1CYP1A2 | |
| SCHEMBL2479710 | 0.75 | TSHR (0.54) | CDC25CTSHRKCNH2CYP1A2CYP2C19 |
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-3143021-B1 | PYRAZOLOPYRIDINES AND PYRAZOLOPYRIMIDINES | PFIZER (US) | 2019-06-12 | — | — | EP | disclosed |