Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | F3 | P13726 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | MIF | P14174 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6745371 | 0.72 | ALDH1A1 (0.37) | CYP1A2F3ALDH1A1HTTMAOB | |
| SCHEMBL11294752 | 0.70 | CYP1A2 (0.43) | CYP1A2F3ALDH1A1HTTMAOB | |
| SCHEMBL6514388 | 0.69 | ALDH1A1 (0.35) | CYP1A2F3ALDH1A1HTTPIM1 | |
| SCHEMBL25400816 | 0.69 | HPGD (0.48) | CYP1A2F3ALDH1A1HTTMAOB | |
| SCHEMBL10632138 | 0.69 | CYP1A2 (0.52) | CYP1A2F3ALDH1A1HTTMAOB | |
| SCHEMBL63597 | 0.69 | CYP1A2 (0.52) | CYP1A2F3ALDH1A1HTTMAOB | |
| SCHEMBL24697596 | 0.67 | CYP1A2 (0.41) | CYP1A2F3ALDH1A1HTTMAOB | |
| Water SCHEMBL1007359 | 0.67 | CYP1A2 (0.50) | CYP1A2F3ALDH1A1HTTMAOB | |
| SCHEMBL31633218 | 0.66 | CYP1A2 (0.48) | CYP1A2F3ALDH1A1HTTMAOB | |
| SCHEMBL33499 | 0.65 | CYP1A2 (0.50) | CYP1A2F3ALDH1A1HTTMAOB |
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 |
|---|---|---|---|---|---|---|---|
| CN-105601480-A | Synthesizing method of fused-ring aryl substituted formaldehyde compound | UNIV HENAN NORMAL | 2016-05-25 | — | — | CN | disclosed |