Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP11 | Q9NR21 | 10/20 | 1.00 |
| ▸ | PARP10 | Q53GL7 | 9/20 | 0.61 |
| ▸ | GRM5 | P41594 | 7/20 | 0.57 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.56 |
| ▸ | PARP1 | P09874 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL10168733 | 0.80 | PARP11 (0.66) | PARP11PARP10GRM5PDPK1PARP1 | |
| SCHEMBL25947316 | 0.80 | PARP11 (0.66) | PARP11PARP10GRM5PDPK1PARP1 | |
| SCHEMBL8870301 | 0.78 | PARP11 (0.63) | PARP11 | |
| SCHEMBL4415080 | 0.77 | MAOB (0.64) | PARP11PARP10GRM5PDPK1PARP1 | |
| SCHEMBL1951410 | 0.77 | PARP11 (0.63) | PARP11PARP10GRM5PDPK1PARP1 | |
| SCHEMBL24852650 | 0.77 | IL4I1 (0.63) | PARP11PARP10GRM5PDPK1PARP1 | |
| SCHEMBL8155722 | 0.76 | PARP11 (1.00) | PARP11PARP10GRM5PDPK1PARP1 | |
| SCHEMBL19386434 | 0.76 | PARP11 (0.61) | PARP11PARP10GRM5PDPK1PARP1 | |
| SCHEMBL20627544 | 0.76 | PARP11 (0.61) | PARP11PARP10GRM5PDPK1PARP1 | |
| SCHEMBL18010818 | 0.76 | TDP2 (0.63) | PARP11 |
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-2017174757-A1 | TETRAHYDROISOQUINOLINE ESTROGEN RECEPTOR MODULATORS AND USES THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2017-10-12 | — | — | WO | disclosed |