Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.51 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.46 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | PRMT5 | O14744 | 4/20 | 0.43 |
| ▸ | WDR77 | Q9BQA1 | 4/20 | 0.43 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.43 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8540509 | 1.00 | RIPK1 (0.51) | RIPK1HSD11B1ADAM17RAB9AROCK2 | |
| SCHEMBL8546239 | 1.00 | RIPK1 (0.51) | RIPK1HSD11B1ADAM17RAB9AROCK2 | |
| SCHEMBL8545905 | 0.99 | RIPK1 (0.50) | RIPK1HSD11B1ADAM17RAB9AROCK2 | |
| SCHEMBL8539202 | 0.99 | RIPK1 (0.50) | RIPK1HSD11B1ADAM17RAB9AROCK2 | |
| SCHEMBL8540459 | 0.96 | RIPK1 (0.56) | RIPK1HSD11B1ADAM17RAB9AHSP90AA1 | |
| SCHEMBL8540457 | 0.96 | RIPK1 (0.56) | RIPK1HSD11B1ADAM17RAB9AHSP90AA1 | |
| SCHEMBL6436515 | 0.79 | ALDH1A1 (0.53) | — | |
| SCHEMBL6435766 | 0.79 | ALDH1A1 (0.53) | — | |
| SCHEMBL6436519 | 0.79 | ALDH1A1 (0.53) | — | |
| SCHEMBL6435771 | 0.79 | ALDH1A1 (0.53) | — |
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-0705259-B1 | PHENYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1998-02-25 | — | — | EP | disclosed |
| EP-0705259-A1 | PHENYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-04-10 | — | — | EP | disclosed |
| WO-1995000508-A1 | PHENYRROLE DERIVATIVES AND THEIR USE AS DOPAMINE D3 ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1995-01-05 | — | — | WO | disclosed |