Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MPO | P05164 | 1/20 | 0.34 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL20194894 | 0.82 | ERN1 (0.38) | ALDH1A1NPSR1MAPK1ERN1LMNA | |
| SCHEMBL3859028 | 0.77 | CASP3 (0.35) | ALDH1A1NPSR1MAPK1MPOHCAR1 | |
| SCHEMBL27346950 | 0.77 | MPO (0.38) | ALDH1A1NPSR1MAPK1MPOHCAR1 | |
| SCHEMBL31672723 | 0.77 | CASP3 (0.35) | ALDH1A1NPSR1MAPK1MPOHCAR1 | |
| SCHEMBL1277178 | 0.77 | ERN1 (0.52) | ALDH1A1HCAR1ERN1SMN1; SMN2TSHR | |
| SCHEMBL14546609 | 0.76 | AMY1A (0.44) | ALDH1A1NQO2LMNASMN1; SMN2BACE1 | |
| SCHEMBL3135909 | 0.74 | SIGMAR1 (0.38) | ALDH1A1NPSR1MAPK1MPOHCAR1 | |
| SCHEMBL27072834 | 0.74 | HCAR1 (0.33) | ALDH1A1NPSR1MAPK1MPOHCAR1 | |
| SCHEMBL22487818 | 0.73 | ERN1 (0.47) | CA1CA2ERN1LMNASMN1; SMN2 | |
| SCHEMBL18713994 | 0.73 | BACE1 (0.41) | ALDH1A1MAPK1ERN1BACE1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016011390-A1 | IRAK4 INHIBITING AGENTS | BIOGEN MA INC. (US) | 2016-01-21 | — | — | WO | disclosed |