Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 3/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.37 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.34 |
| ▸ | PRCP | P42785 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 4/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2242767 | 0.78 | KDM4E (0.44) | HTR6KDM4ENPC1ALDH1A1LMNA | |
| SCHEMBL2248187 | 0.74 | GBA1 (0.48) | — | |
| SCHEMBL9311027 | 0.70 | HTR6 (0.75) | HTR6ESR1ESR2SLC22A1PRCP | |
| SCHEMBL2242306 | 0.69 | ALDH1A1 (0.49) | KDM4ENPC1ALDH1A1LMNAGLA | |
| SCHEMBL22606737 | 0.69 | HTR6 (0.55) | HTR6ESR1ESR2MTNR1AMTNR1B | |
| SCHEMBL2245636 | 0.69 | GBA1 (0.44) | HTR6KDM4ENPC1ALDH1A1LMNA | |
| SCHEMBL27579440 | 0.68 | HTR6 (0.51) | HTR6IDO1 | |
| SCHEMBL2243951 | 0.68 | IDO1 (0.40) | KDM4ENPC1ALDH1A1LMNAGLA | |
| SCHEMBL27780844 | 0.68 | GBA1 (0.50) | KDM4ENPC1ALDH1A1LMNAGLA | |
| SCHEMBL1615946 | 0.66 | GBA1 (0.48) | — |
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-2099763-B1 | 2-AMINOQUINOLINES AS 5-HT(5A) RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-08-11 | — | — | EP | disclosed |