Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.40 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL25845085 | 0.84 | POLB (0.44) | ALDH1A1CYP3A4SMN1; SMN2POLBALKBH5 | |
| SCHEMBL5218336 | 0.78 | ALDH1A1 (0.42) | ALDH1A1CYP3A4SMN1; SMN2POLBALKBH5 | |
| SCHEMBL12866043 | 0.78 | ALDH1A1 (0.42) | ALDH1A1CYP3A4SMN1; SMN2POLBALKBH5 | |
| SCHEMBL30951061 | 0.76 | ALDH1A1 (0.41) | ALDH1A1CYP3A4SMN1; SMN2POLBALKBH5 | |
| SCHEMBL1171938 | 0.76 | ALDH1A1 (0.41) | ALDH1A1CYP3A4SMN1; SMN2POLBALKBH5 | |
| SCHEMBL27533953 | 0.76 | ALDH1A1 (0.41) | ALDH1A1CYP3A4SMN1; SMN2POLBALKBH5 | |
| SCHEMBL7134467 | 0.76 | LMNA (0.54) | ALDH1A1CYP3A4SMN1; SMN2POLBALKBH5 | |
| SCHEMBL5215814 | 0.76 | NPC1 (0.44) | ALDH1A1SMN1; SMN2KMT2AMEN1MAPT | |
| SCHEMBL5216404 | 0.75 | KMT2A (0.42) | ALDH1A1CYP3A4SMN1; SMN2KMT2AMEN1 | |
| SCHEMBL12467259 | 0.74 | ALDH1A1 (0.39) | ALDH1A1CYP3A4SMN1; SMN2POLBMAPT |
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-2012052420-A1 | METHOD FOR PREPARING SUBSTITUTED N-(3-AMINO-QUINOXALIN-2-YL)-SULFONAMIDES AND THEIR INTERMEDIATES N-(3-CHLORO-QUINOXALIN-2-YL)SULFONAMIDES | MERCK SERONO S.A. GENEVA (CH) | 2012-04-26 | — | — | WO | disclosed |