Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.85 |
| ▸ | MEN1 | O00255 | 2/20 | 0.85 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.63 |
| ▸ | CXCR3 | P49682 | 3/20 | 0.55 |
| ▸ | MC4R | P32245 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.51 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.50 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13073431 | 1.00 | KMT2A (0.85) | KMT2AMEN1HDAC8CXCR3MC4R | |
| SCHEMBL29744500 | 0.87 | MEN1 (0.67) | KMT2AMEN1HDAC8CXCR3MC4R | |
| SCHEMBL19972734 | 0.87 | MEN1 (0.67) | KMT2AMEN1HDAC8CXCR3MC4R | |
| SCHEMBL6240572 | 0.87 | KMT2A (0.70) | KMT2AMEN1HDAC8CXCR3MC4R | |
| Hydrochloric Acid SCHEMBL4786521 | 0.86 | KMT2A (0.73) | KMT2AMEN1HDAC8CXCR3MC4R | |
| SCHEMBL6368964 | 0.83 | KMT2A (0.64) | KMT2AMEN1HDAC8CXCR3PRMT5 | |
| SCHEMBL6937981 | 0.82 | KMT2A (0.71) | KMT2AMEN1HDAC8CXCR3PRMT5 | |
| SCHEMBL7995096 | 0.82 | KMT2A (0.71) | KMT2AMEN1HDAC8CXCR3PRMT5 | |
| SCHEMBL928059 | 0.82 | MEN1 (0.60) | KMT2AMEN1HDAC8MC4RTAAR1 | |
| SCHEMBL13074367 | 0.81 | MEN1 (0.59) | KMT2AMEN1HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3512832-A1 | TETRAHYDROISOQUINOLINE KAPPA OPIOID ANTAGONISTS | Research Triangle Institute, International (US) | 2019-07-24 | — | — | EP | claimed |
| WO-2018053222-A1 | TETRAHYDROISOQUINOLINE KAPPA OPIOID ANTAGONISTS | RESEARCH TRAINGLE INSTITUTE (US) | 2018-03-22 | — | — | WO | claimed |