Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 10/20 | 0.38 |
| ▸ | BCHE | P06276 | 6/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL16239528 | 0.89 | ACHE (0.41) | ACHEBCHECYP2C9 | |
| SCHEMBL16239475 | 0.88 | ALDH1A1 (0.39) | ALDH1A1LMNAKDM4EACHEBCHE | |
| SCHEMBL2615616 | 0.87 | BRD4 (0.36) | ALDH1A1LMNAKDM4EACHEBCHE | |
| SCHEMBL2134698 | 0.87 | PTK2B (0.45) | ALDH1A1LMNAKDM4ETSHRHSD11B1 | |
| SCHEMBL16239500 | 0.87 | SLC10A2 (0.40) | ALDH1A1LMNAACHEBCHERXRA | |
| SCHEMBL16239793 | 0.85 | ACHE (0.41) | ACHEBCHE | |
| SCHEMBL2133452 | 0.84 | CCR2 (0.39) | ALDH1A1LMNAKDM4ETSHRHSD11B1 | |
| SCHEMBL16240044 | 0.83 | L3MBTL1 (0.42) | ALDH1A1LMNAKDM4EACHEBCHE | |
| SCHEMBL2140344 | 0.83 | TSHR (0.51) | ALDH1A1LMNAKDM4ETSHRHSD11B1 | |
| SCHEMBL16239546 | 0.83 | USP2 (0.40) | ACHEBCHE |
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-2630124-B1 | TETRAHYDROQUINOLINE DERIVATIVES USED AS AMPK ACTIVATORS | HOFFMANN LA ROCHE (CH) | 2014-11-19 | — | — | EP | claimed |