Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 5/20 | 0.47 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.47 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | RXRA | P19793 | 1/20 | 0.39 |
| ▸ | RXRB | P28702 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10984633 | 0.81 | ALDH1A1 (0.39) | ALDH1A1FFAR1NPC1RAB9ARXRA | |
| SCHEMBL11115339 | 0.81 | NPC1 (0.43) | POLBALDH1A1FFAR1NPC1RAB9A | |
| SCHEMBL11114869 | 0.78 | ALDH1A1 (0.42) | POLBALDH1A1FFAR1NPC1RAB9A | |
| SCHEMBL8936259 | 0.78 | SLC6A1 (0.51) | FFAR1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL10988964 | 0.77 | FFAR1 (0.40) | POLBTDP1ALDH1A1FFAR1NPC1 | |
| SCHEMBL5757559 | 0.76 | PTGER4 (0.51) | FFAR1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL11282578 | 0.75 | RXRA (0.43) | AKR1C3AKR1C2PTGS1L3MBTL1POLB | |
| SCHEMBL1741211 | 0.75 | AKR1C3 (0.58) | AKR1C3AKR1C2AKR1C1PTGS1L3MBTL1 | |
| SCHEMBL7908556 | 0.74 | MAOB (0.56) | PTGS1L3MBTL1FFAR1LMNA | |
| SCHEMBL22095156 | 0.73 | AKR1C3 (0.73) | AKR1C3AKR1C2AKR1C1PTGS1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0118867-A2 | Substituted 4,10-dihydro-10-oxothieno benzoxepins, a method of preparing the same and intermediate thereof and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1984-09-19 | — | — | EP | disclosed |