Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.41 |
| ▸ | IDH1 | O75874 | 5/20 | 0.39 |
| ▸ | CDK9 | P50750 | 3/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | DYRK2 | Q92630 | 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 | |
|---|---|---|---|---|
| SCHEMBL2343261 | 0.78 | OPRM1 (0.42) | HCAR1CDK9ACACBKDM4EALDH1A1 | |
| SCHEMBL2362323 | 0.76 | CYP11B2 (0.50) | TP53HCAR1CDK9CCNT1KDM4E | |
| SCHEMBL11111590 | 0.76 | CNR2 (0.45) | TP53HCAR1KDM4EALDH1A1L3MBTL1 | |
| SCHEMBL2360920 | 0.75 | HCAR1 (0.50) | TP53HCAR1CDK9CCNT1KDM4E | |
| SCHEMBL2361420 | 0.75 | NFE2L2 (0.46) | HCAR1ACACBKDM4EALDH1A1MAPT | |
| SCHEMBL2361663 | 0.74 | HRH3 (0.49) | ROCK1 | |
| SCHEMBL2362031 | 0.73 | TP53 (0.49) | TP53HCAR1CDK9CCNT1KDM4E | |
| SCHEMBL14247637 | 0.73 | HCAR1 (0.48) | TP53HCAR1CDK9CCNT1KDM4E | |
| SCHEMBL21310911 | 0.72 | ALDH1A1 (0.52) | TP53HCAR1IDH1ALDH1A1MAPT | |
| SCHEMBL989522 | 0.72 | L3MBTL1 (0.41) | HCAR1IDH1KDM4EALDH1A1MAPT |
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 |