Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.61 |
| ▸ | HPGD | P15428 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3397041 | 0.85 | ALDH1A1 (0.60) | ALDH1A1HPGDTSHRMAPTHTT | |
| SCHEMBL7259653 | 0.80 | TSHR (0.46) | ALDH1A1HPGDTSHRMAPTL3MBTL1 | |
| SCHEMBL5584032 | 0.79 | ALDH1A1 (0.58) | ALDH1A1HPGDTSHRHTTL3MBTL1 | |
| SCHEMBL8334178 | 0.78 | ALDH1A1 (0.71) | ALDH1A1HPGDTSHRPOLBMAPT | |
| SCHEMBL5584033 | 0.78 | ALDH1A1 (0.51) | ALDH1A1HPGDTSHRPOLBHTT | |
| SCHEMBL181041 | 0.76 | ALDH1A1 (1.00) | ALDH1A1HPGDTSHRPOLBMAPT | |
| SCHEMBL2214742 | 0.76 | ALDH1A1 (0.67) | ALDH1A1HPGDTSHRPOLBMAPT | |
| SCHEMBL3202573 | 0.75 | ALDH1A1 (0.72) | ALDH1A1HPGDTSHRHTTSIGMAR1 | |
| SCHEMBL10628398 | 0.75 | ALDH1A1 (0.49) | ALDH1A1HPGDTSHRMAPTHTT | |
| SCHEMBL10630401 | 0.75 | ALDH1A1 (0.56) | ALDH1A1HPGDTSHRPOLBMAPT |
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-2003029188-A2 | BETA-SUBSTITUTED NITROSTYRENE AND CYANOSTYRENE COMPOUNDS AND THEIR USE AS NEMATICIDES AND FUNGICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2003-04-10 | — | — | WO | disclosed |