Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27939674 | 0.79 | ALDH1A1 (0.33) | ALDH1A1LMNAMAPTTSHRSMN1; SMN2 | |
| SCHEMBL8980362 | 0.78 | SLC6A3 (0.48) | ALDH1A1LMNATSHRTDP1SLC6A3 | |
| SCHEMBL7288149 | 0.71 | EPHX1 (0.39) | ALDH1A1MAPTSMN1; SMN2KMT2AHTT | |
| SCHEMBL27370728 | 0.71 | EPHX1 (0.39) | SLC6A3SLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL6683095 | 0.70 | EPHX1 (0.38) | ALDH1A1LMNATSHRRAB9AHIF1A | |
| Hydrochloric Acid SCHEMBL6671575 | 0.70 | EPHX1 (0.38) | ALDH1A1LMNATSHRRAB9AHIF1A | |
| Hydrochloric Acid SCHEMBL6666146 | 0.70 | EPHX1 (0.38) | ALDH1A1LMNATSHRRAB9AHIF1A | |
| Hydrochloric Acid SCHEMBL6666144 | 0.70 | EPHX1 (0.38) | ALDH1A1LMNATSHRRAB9AHIF1A | |
| Hydrochloric Acid SCHEMBL6671579 | 0.70 | EPHX1 (0.38) | ALDH1A1LMNATSHRRAB9AHIF1A | |
| SCHEMBL28839989 | 0.69 | ATM (0.38) | ALDH1A1LMNATSHRATMTDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103347859-B | Synthesis and Anticancer Activity of Aryl and Heteroaryl Quinoline Derivatives | EFFICIENT PHARMA MANAGEMENT CORP. (CN) | 2015-12-02 | — | — | CN | disclosed |
| US-5571822-A | AMINO-2-PHENYL-4-QUINOLONE DERIVATIVES | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 1996-11-05 | — | — | US | disclosed |
| WO-1996010563-A1 | 2-ARYL-4-QUINOLONES AS ANTITUMOR COMPOUNDS | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 1996-04-11 | — | — | WO | disclosed |