Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCKDK | O14874 | 2/20 | 0.67 |
| ▸ | RAB9A | P51151 | 4/20 | 0.59 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | ESR1 | P03372 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.48 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.48 |
| ▸ | TLR3 | O15455 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL31053391 | 0.89 | BCKDK (0.71) | BCKDKRAB9AMCL1RXFP1SMN1; SMN2 | |
| SCHEMBL31053341 | 0.87 | BCKDK (0.60) | BCKDKRAB9ARXFP1SMN1; SMN2NPC1 | |
| SCHEMBL31053392 | 0.84 | BCKDK (0.65) | BCKDKRAB9AMCL1RXFP1SMN1; SMN2 | |
| SCHEMBL31053323 | 0.83 | BCKDK (0.56) | BCKDKRAB9ARXFP1SMN1; SMN2NPC1 | |
| SCHEMBL31053385 | 0.83 | BCKDK (0.63) | BCKDKRAB9AMCL1RXFP1SMN1; SMN2 | |
| SCHEMBL31053345 | 0.83 | BCKDK (0.59) | BCKDKRAB9AMCL1RXFP1SMN1; SMN2 | |
| SCHEMBL21513634 | 0.81 | PRNP (0.64) | BCKDKRAB9ARXFP1SMN1; SMN2NPC1 | |
| SCHEMBL31053350 | 0.81 | BCKDK (0.63) | BCKDKRAB9AMCL1RXFP1SMN1; SMN2 | |
| SCHEMBL2279755 | 0.80 | BCKDK (0.77) | BCKDKRAB9AMCL1RXFP1SMN1; SMN2 | |
| SCHEMBL594468 | 0.80 | BCKDK (1.00) | BCKDKRAB9AMCL1RXFP1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5140024-A | Thienofuro- or thienodiazepines and pyridofuro- or thienodizsepines; antisecretory and -inflammatory agents; gastrointestinal disorders | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1992-08-18 | — | — | US | disclosed |
| US-4985423-A | New 1,4-diazepine derivatives having anit-ulcer activity | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1991-01-15 | — | — | US | disclosed |
| EP-0350131-A2 | New 1,4-diazepine derivatives having anti-ulcer activity | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1990-01-10 | — | — | EP | disclosed |