Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA7 | P43166 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 3/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6998918 | 0.80 | HSP90AA1 (0.38) | TSHRACHECA12CA1CA2 | |
| SCHEMBL7002090 | 0.79 | CYP1A2 (0.40) | TSHRACHECA12CA1CA2 | |
| SCHEMBL6998914 | 0.73 | HSP90AA1 (0.38) | TSHRACHECA12CA1CA2 | |
| SCHEMBL31309801 | 0.73 | ACHE (0.41) | TSHRACHECA12CA1CA2 | |
| SCHEMBL10447298 | 0.71 | TSHR (0.48) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL14195937 | 0.70 | CYP1A2 (0.48) | TSHRCYP1A2LMNA | |
| SCHEMBL23382300 | 0.69 | KMT2A (0.40) | TSHRACHECA12CA1CA2 | |
| SCHEMBL14593070 | 0.69 | KDM4E (0.40) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL2585836 | 0.68 | TSHR (0.38) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL9233379 | 0.68 | ALDH1A1 (0.42) | TSHRACHECA12CA1CA2 |
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-1123296-B1 | PYRAZOLOPYRIMIDINONE cGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION | PFIZER LTD (GB) | 2003-09-17 | — | — | EP | disclosed |