Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8157722 | 0.78 | ALDH1A1 (0.61) | TSHRKDM4EPOLBALDH1A1NPSR1 | |
| SCHEMBL4889465 | 0.78 | TSHR (0.50) | TSHRKDM4EPOLBALDH1A1AR | |
| SCHEMBL2398930 | 0.78 | TSHR (0.50) | TSHRKDM4EPOLBALDH1A1CA1 | |
| SCHEMBL23273064 | 0.77 | TSHR (0.45) | TSHRKDM4EPOLBALDH1A1NPSR1 | |
| SCHEMBL8743631 | 0.76 | TSHR (0.44) | TSHRKDM4EPOLBALDH1A1TACR1 | |
| SCHEMBL23273063 | 0.76 | TSHR (0.44) | TSHRKDM4EPOLBALDH1A1NPSR1 | |
| SCHEMBL9521927 | 0.75 | TSHR (0.47) | TSHRKDM4EPOLBALDH1A1AR | |
| SCHEMBL18526730 | 0.75 | KDM4E (0.53) | TSHRKDM4EPOLBALDH1A1AR | |
| SCHEMBL28991495 | 0.75 | TSHR (0.42) | TSHRKDM4EPOLBALDH1A1NPSR1 | |
| Potassium Ion SCHEMBL29823215 | 0.75 | TSHR (0.42) | TSHRKDM4EPOLBALDH1A1NPSR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0335770-B1 | Novel fluorophosphonate nucleotide derivatives | MERRELL PHARMA INC (US) | 1997-01-15 | — | — | EP | disclosed |
| EP-0339161-A1 | Novel fluorophosphonate nucleotide derivatives | MERRELL DOW PHARMACEUTICALS INC. (US) | 1989-11-02 | — | — | EP | disclosed |
| EP-0335770-A2 | Novel fluorophosphonate nucleotide derivatives | MERRELL PHARMACEUTICALS INC. (US) | 1989-10-04 | — | — | EP | disclosed |