Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | GPR3 | P46089 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL3970688 | 0.75 | PDE10A (0.56) | HSD17B10ALDH1A1HPGDCYP1A2NUDT1 | |
| SCHEMBL9821030 | 0.74 | TLR8 (0.49) | HSD17B10ALDH1A1HPGDCYP1A2NUDT1 | |
| SCHEMBL8879814 | 0.73 | GCGR (0.41) | ALDH1A1HPGDUSP2RAD52RXFP1 | |
| SCHEMBL5501886 | 0.73 | SMN1; SMN2 (0.70) | SMN1; SMN2GPR3NPSR1KDM4EGAA | |
| SCHEMBL12767717 | 0.72 | ERN1 (0.54) | HSD17B10ALDH1A1HPGDCYP1A2NUDT1 | |
| SCHEMBL23682827 | 0.69 | ERN1 (0.54) | HSD17B10ALDH1A1HPGDCYP1A2NUDT1 | |
| SCHEMBL9611245 | 0.68 | KDM4E (0.57) | HSD17B10ALDH1A1HPGDSMN1; SMN2TP53 | |
| SCHEMBL10015630 | 0.68 | GPR3 (0.53) | HSD17B10ALDH1A1HPGDCYP1A2NUDT1 | |
| SCHEMBL16256145 | 0.67 | HTT (0.46) | HSD17B10ALDH1A1HPGDCYP1A2NUDT1 | |
| SCHEMBL9821028 | 0.67 | HSD17B10 (0.55) | HSD17B10ALDH1A1HPGDCYP1A2NUDT1 |
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-0258755-A1 | Alpha-alkyl-4-amino-3-quinoline-methanols and 1-(4-aralkylamino-3-quinolinyl) alkanones, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1988-03-09 | — | — | EP | disclosed |