Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH2 | P05091 | 8/20 | 0.61 |
| ▸ | NPC1 | O15118 | 5/20 | 0.58 |
| ▸ | RAB9A | P51151 | 5/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.58 |
| ▸ | MEN1 | O00255 | 4/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | HPGD | P15428 | 4/20 | 0.58 |
| ▸ | TP53 | P04637 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.58 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.58 |
| ▸ | RELA | Q04206 | 3/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.58 |
| ▸ | MAOA | P21397 | 8/20 | 0.58 |
| ▸ | MAOB | P27338 | 8/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL26848473 | 0.90 | ALDH2 (0.63) | ALDH2NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL11940752 | 0.89 | ALDH2 (0.65) | ALDH2NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL2751806 | 0.88 | ALDH2 (0.62) | ALDH2NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL2751140 | 0.86 | ACHE (0.56) | ALDH2NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL26145338 | 0.82 | NPC1 (0.71) | ALDH2NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL2750470 | 0.81 | ALDH2 (0.71) | ALDH2NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL30584234 | 0.81 | MEN1 (0.64) | ALDH2NPC1RAB9ASMN1; SMN2MEN1 | |
| 7-Acetoxy-4',5-Dihydroxygenistein SCHEMBL10001910 | 0.81 | ALDH2 (0.75) | ALDH2NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL13492283 | 0.79 | ALDH2 (0.51) | ALDH2NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL7565641 | 0.78 | MEN1 (0.63) | ALDH2NPC1RAB9ASMN1; SMN2MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8623910-B2 | Isoflavones for treating mucopolysaccharidoses | INSTYTUT FARMACEUTYCZNY (PL) | 2014-01-07 | — | — | US | claimed |
| US-8178609-B2 | Isoflavones for treating mucopolysaccharidoses | INSTYTUT FARMACEUTYCZNY (PL) | 2012-05-15 | — | — | US | claimed |