Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.37 |
| ▸ | CACNB2 | Q08289 | 1/20 | 0.37 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | LPL | P06858 | 1/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.35 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12169133 | 0.81 | CHRNA7 (0.33) | CHRNA7ACHETDP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL28186864 | 0.81 | CHRNA7 (0.33) | CHRNA7ACHETDP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL7199129 | 0.80 | CHRNA7 (0.39) | CHRNA7ACHETDP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL1200882 | 0.80 | TSHR (0.60) | CHRNA7ACHETDP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL8943828 | 0.80 | ALDH1A1 (0.41) | CHRNA7ACHETDP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL3991740 | 0.80 | TSHR (0.60) | CHRNA7ACHETDP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL2686081 | 0.80 | VCP (0.46) | ALDH1A1SMN1; SMN2FFAR1CACNA2D1CACNB2 | |
| SCHEMBL20865650 | 0.77 | ACHE (0.45) | ACHETDP1ALDH1A1SMN1; SMN2ALOX5 | |
| SCHEMBL8210082 | 0.76 | ACHE (0.44) | CHRNA7ACHETDP1ALDH1A1ALOX5 | |
| SCHEMBL10863597 | 0.75 | ALDH1A1 (0.33) | ACHEALDH1A1SMN1; SMN2FFAR1ALOX5 |
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-1993022259-A1 | A PROCESS FOR PRODUCING 1,4-BISARYL-BUTANE-1,4-DIONES AND POLY(ARYLENE-BUTANE-1,4-DIONES) | NKT RESEARCH CENTER A/S (DK) | 1993-11-11 | — | — | WO | disclosed |