Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 19/20 | 0.45 |
| ▸ | IKBKE | Q14164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.41 |
| ▸ | CDK9 | P50750 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18985420 | 0.83 | TBK1 (0.57) | TBK1IKBKECCNT1CDK9 | |
| SCHEMBL19005014 | 0.81 | POLB (0.51) | TBK1IKBKECCNT1CDK9 | |
| SCHEMBL18985710 | 0.79 | TBK1 (0.47) | TBK1IKBKEALDH1A1 | |
| SCHEMBL18985576 | 0.77 | TBK1 (0.72) | TBK1IKBKE | |
| SCHEMBL18986000 | 0.74 | TBK1 (0.66) | TBK1 | |
| SCHEMBL18985935 | 0.71 | TBK1 (0.59) | TBK1IKBKECCNT1CDK9 | |
| SCHEMBL19004876 | 0.71 | NPSR1 (0.52) | TBK1IKBKECCNT1CDK9 | |
| Hydrochloric Acid SCHEMBL18985421 | 0.71 | TBK1 (0.58) | TBK1IKBKECCNT1CDK9 | |
| SCHEMBL1663106 | 0.69 | MEN1 (0.68) | MEN1NPC1ALDH1A1HPGDRAB9A | |
| SCHEMBL18985777 | 0.68 | KDM4E (0.48) | TBK1IKBKEALDH1A1 |
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-2017102091-A1 | HETEROARYLBENZIMIDAZOLE COMPOUNDS | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2017-06-22 | — | — | WO | disclosed |