Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | GFER | P55789 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CTSD | P07339 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 4/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17582958 | 0.85 | CYP11B2 (0.52) | HTR2BHTR6ALDH1A1CTSDUSP2 | |
| SCHEMBL2361800 | 0.83 | KDM4E (0.49) | HTR2BHTR6ALDH1A1KDM4EMAPT | |
| SCHEMBL2027616 | 0.76 | PRKACA (0.60) | ALDH1A1KDM4EMAPTGFERTDP1 | |
| SCHEMBL21311255 | 0.75 | OPRM1 (0.59) | ALDH1A1KDM4EMAPTGFERTDP1 | |
| SCHEMBL28428214 | 0.73 | NOS2 (0.50) | HTR2BHTR6ALDH1A1KDM4ECTSD | |
| SCHEMBL2929873 | 0.73 | RPS6KB1 (0.58) | MAPTMEN1KMT2AHCAR1L3MBTL1 | |
| SCHEMBL17582939 | 0.73 | CTSD (0.40) | HTR2BHTR6ALDH1A1KDM4EMAPT | |
| SCHEMBL16060516 | 0.73 | CTSD (0.40) | HTR2BHTR6CTSDHCAR1CYP11B2 | |
| SCHEMBL1926108 | 0.73 | ALDH1A1 (0.47) | ALDH1A1KDM4EMAPTGFERTDP1 | |
| SCHEMBL2360807 | 0.72 | CACNA1D (0.52) | KDM4ECTSDPKMCACNA1DMEN1 |
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-2011099832-A2 | NOVEL BENZIMIDAZOLE COMPOUND, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | CRYSTALGENOMICS, INC. (KR) | 2011-08-18 | — | — | WO | disclosed |