Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | PPARA | Q07869 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.32 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3433240 | 0.81 | SIGMAR1 (0.48) | SIGMAR1MEN1CYP2C9KMT2AHDAC9 | |
| SCHEMBL11220224 | 0.73 | MAPT (0.35) | SIGMAR1NPSR1HTTLMNA | |
| SCHEMBL7606467 | 0.73 | PKM (0.40) | NPSR1MEN1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL17208907 | 0.71 | ADRA2A (0.35) | HTTBACE1 | |
| SCHEMBL19852351 | 0.68 | KDM1A (0.38) | SIGMAR1HSD11B1HTT | |
| SCHEMBL27949831 | 0.67 | MEN1 (0.42) | HSD11B1MEN1CYP2C9KMT2AHDAC9 | |
| SCHEMBL9386634 | 0.66 | HSD11B1 (0.34) | SIGMAR1HSD11B1CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9386607 | 0.65 | HSD11B1 (0.33) | SIGMAR1HSD11B1NPSR1LMNABACE1 | |
| SCHEMBL2009422 | 0.65 | SIGMAR1 (0.41) | SIGMAR1LMNABACE1 | |
| SCHEMBL25763033 | 0.64 | KCNH2 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0004579-B1 | FLAVANS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | THE WELLCOME FOUNDATION LIMITED (GB) | 1982-08-18 | — | — | EP | claimed |
| EP-0004579-A1 | Flavans, process for their preparation and pharmaceutical compositions containing them | THE WELLCOME FOUNDATION LIMITED (GB) | 1979-10-17 | — | — | EP | disclosed |