Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | AURKA | O14965 | 5/20 | 0.43 |
| ▸ | LCK | P06239 | 5/20 | 0.43 |
| ▸ | KDR | P35968 | 5/20 | 0.43 |
| ▸ | TEK | Q02763 | 5/20 | 0.43 |
| ▸ | MET | P08581 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11272743 | 0.99 | ALDH1A1 (0.44) | ALDH1A1KDM4EHPGDHSD17B10AURKA | |
| Hydrochloric Acid SCHEMBL11270206 | 0.84 | ADRB2 (0.38) | ALDH1A1KDM4EHPGDHSD17B10AURKA | |
| SCHEMBL11266462 | 0.82 | ADRB2 (0.39) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| Hydrochloric Acid SCHEMBL11287441 | 0.81 | ADRB2 (0.38) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL6543394 | 0.79 | HPGDS (0.57) | ALDH1A1KDM4EHPGDHSD17B10AURKA | |
| SCHEMBL10767145 | 0.79 | NPC1 (0.58) | ALDH1A1HPGDGAANPSR1KMT2A | |
| SCHEMBL27451761 | 0.77 | KDM4E (0.54) | ALDH1A1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL11267179 | 0.75 | KDM4E (0.55) | ALDH1A1KDM4EHPGDHSD17B10AURKA | |
| SCHEMBL11281108 | 0.75 | ALDH1A1 (0.69) | ALDH1A1KDM4EHPGDHSD17B10LCK | |
| SCHEMBL11268789 | 0.75 | MAPT (0.48) | ALDH1A1KDM4EHPGDHSD17B10GAA |
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 |