Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.58 |
| ▸ | MAPT | P10636 | 5/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.58 |
| ▸ | GAA | P10253 | 5/20 | 0.58 |
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | GUSB | P08236 | 1/20 | 0.58 |
| ▸ | MAOA | P21397 | 7/20 | 0.55 |
| ▸ | MAOB | P27338 | 5/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | CASP3 | P42574 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL28451541 | 0.89 | GAA (0.58) | MEN1MAPTKMT2AGAARAB9A | |
| SCHEMBL28451538 | 0.89 | MAOA (0.55) | MEN1MAPTKMT2AGAARAB9A | |
| SCHEMBL28897057 | 0.88 | MAOB (0.55) | MEN1MAPTKMT2AGAARAB9A | |
| SCHEMBL28442631 | 0.84 | GUSB (0.61) | MEN1MAPTKMT2AGAARAB9A | |
| SCHEMBL25613862 | 0.78 | GUSB (0.67) | MEN1MAPTKMT2AGAARAB9A | |
| SCHEMBL1068115 | 0.77 | MAPT (0.74) | MEN1MAPTKMT2AGAARAB9A | |
| SCHEMBL12932196 | 0.77 | MAPT (0.74) | MEN1MAPTKMT2AGAARAB9A | |
| SCHEMBL16742057 | 0.76 | GUSB (0.64) | MEN1MAPTKMT2AGAARAB9A | |
| SCHEMBL16742058 | 0.76 | GUSB (0.64) | MEN1MAPTKMT2AGAARAB9A | |
| SCHEMBL20956437 | 0.72 | DHODH (0.85) | MEN1MAPTKMT2AGAARAB9A |
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-111533696-A | Benzimidazole derivative, benzothiophene derivative, and preparation method and application thereof | 苏州大学 | 2020-08-14 | — | — | CN | disclosed |