Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 12/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.33 |
| ▸ | SLC6A5 | Q9Y345 | 3/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2879213 | 0.76 | SLC6A9 (0.38) | SLC6A9OPRM1SLC6A5OPRL1KCNH2 | |
| Hydrochloric Acid SCHEMBL9037991 | 0.75 | SIGMAR1 (0.39) | SLC6A9OPRM1SLC6A5OPRL1KCNH2 | |
| SCHEMBL5174722 | 0.69 | KDM1A (0.31) | — | |
| SCHEMBL5556604 | 0.63 | SLC6A3 (0.39) | SLC6A9OPRM1CYP1A2MAPTCYP2C19 | |
| SCHEMBL8809000 | 0.63 | SLC6A9 (0.40) | SLC6A9OPRM1SLC6A5KCNH2TDP1 | |
| SCHEMBL2168757 | 0.59 | CCNC (0.32) | — | |
| SCHEMBL7262782 | 0.58 | OTUD7B (0.55) | MAPTMEN1POLBKMT2A | |
| Doxenitoin SCHEMBL667654 | 0.58 | KMT2A (0.50) | OPRM1KCNH2CYP1A2MAPTMEN1 | |
| SCHEMBL12028825 | 0.57 | DDB1 (0.36) | SLC6A9OPRM1SLC6A5OPRL1KCNH2 | |
| SCHEMBL1138335 | 0.57 | SLC6A9 (0.56) | SLC6A9OPRM1SLC6A5OPRL1KCNH2 |
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-1119548-A1 | PYRROLE-2,5-DIONES AS GSK-3 INHIBITORS | SMITHKLINE BEECHAM PLC (GB) | 2001-08-01 | — | — | EP | disclosed |
| WO-2000021927-A2 | PYRROLE-2,5-DIONES AS GSK-3 INHIBITORS | SMITHKLINE BEECHAM PLC (GB) | 2000-04-20 | — | — | WO | disclosed |