Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.48 |
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | MITF | O75030 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11003187 | 0.86 | APP (0.55) | APPALDH1A1KDM4EHPGDGAA | |
| SCHEMBL4589826 | 0.80 | PTGS1 (0.73) | PTGS1AKR1C3AKR1C2ALDH1A1KDM4E | |
| SCHEMBL11281357 | 0.78 | PTGS1 (0.53) | PTGS1AKR1C3AKR1C2ALDH1A1KDM4E | |
| SCHEMBL4002523 | 0.78 | ALDH1A1 (0.56) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL11080912 | 0.77 | ALDH1A1 (0.45) | APPALDH1A1KDM4EGAAHTT | |
| SCHEMBL14240762 | 0.77 | APP (0.44) | APPALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL11277313 | 0.77 | L3MBTL1 (0.52) | PTGS1AKR1C3AKR1C2ALDH1A1MEN1 | |
| SCHEMBL3006819 | 0.76 | CYP2C8 (0.61) | ALDH1A1KDM4EHPGDHSD17B10NPC1 | |
| SCHEMBL11271316 | 0.76 | KMT2A (0.55) | PTGS1AKR1C3AKR1C2KDM4EGAA | |
| SCHEMBL11282231 | 0.76 | HSP90AA1 (0.66) | ALDH1A1HPGDLMNAMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4327022-A | Heterocyclic alkyl naphthols | STERLING DRUG INC. (US) | 1982-04-27 | — | — | US | disclosed |
| US-4169108-A | 5(OR 6)-[(Substituted-amino)alkyl]-2,3-naphthalenediols | STERLING DRUG INC. (US) | 1979-09-25 | — | — | US | disclosed |