Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 2/20 | 0.34 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.34 |
| ▸ | PRKDC | P78527 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6828395 | 0.80 | CA2 (0.36) | IMPDH2PTPN1CA1CA2 | |
| SCHEMBL6922829 | 0.78 | ERN1 (0.39) | ERN1IMPDH2PRKDCPTPN1CA1 | |
| SCHEMBL11766667 | 0.76 | ALDH1A1 (0.36) | ERN1CA1CA2 | |
| SCHEMBL13894546 | 0.75 | IMPDH2 (0.37) | IMPDH2CA1CA2 | |
| SCHEMBL7959993 | 0.73 | CA1 (0.32) | ERN1PRKDCCA1CA2 | |
| SCHEMBL6830384 | 0.73 | ALDH1A1 (0.44) | IMPDH2PTPN1CA1CA2 | |
| SCHEMBL6828158 | 0.71 | PTPN1 (0.40) | IMPDH2PTPN1 | |
| SCHEMBL12348412 | 0.71 | CA2 (0.33) | IMPDH2PTPN1CA1CA2 | |
| SCHEMBL3678520 | 0.71 | ALDH1A1 (0.36) | ERN1CA1CA2 | |
| SCHEMBL18633670 | 0.71 | CA2 (0.36) | IMPDH2PTPN1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004073612-A2 | ESTROGEN RECEPTOR MODULATORS | MERCK & CO. INC. (US) | 2004-09-02 | — | — | WO | disclosed |