Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 2/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19004853 | 0.94 | IRAK4 (0.43) | HPGDSEGFRADORA1PKMCYP1A2 | |
| SCHEMBL22897343 | 0.83 | EGFR (0.44) | HPGDSEGFRADORA1PKMCYP1A2 | |
| SCHEMBL19005056 | 0.78 | HPGDS (0.40) | HPGDSEGFRPKMMAP4K4LMNA | |
| SCHEMBL19004855 | 0.74 | BTK (0.40) | EGFRADORA2AJAK2JAK1 | |
| SCHEMBL21159561 | 0.73 | HPGDS (0.53) | HPGDSEGFRADORA1PKMCYP1A2 | |
| SCHEMBL17369356 | 0.72 | GSK3B (0.46) | HSD17B10 | |
| SCHEMBL19917073 | 0.71 | CD38 (0.46) | HPGDSEGFRADORA1PKMCYP1A2 | |
| SCHEMBL9607736 | 0.71 | ADORA1 (0.51) | EGFRADORA1TP53POLBLMNA | |
| SCHEMBL21138338 | 0.69 | HPGDS (0.47) | HPGDSEGFRADORA1PKMCYP1A2 | |
| SCHEMBL30808262 | 0.69 | HPGDS (0.47) | HPGDSEGFRADORA1PKMCYP1A2 |
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 |