Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CHKA | P35790 | 1/20 | 0.42 |
| ▸ | RPS6KB1 | P23443 | 6/20 | 0.37 |
| ▸ | AKT1 | P31749 | 5/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 2/20 | 0.34 |
| ▸ | DPP4 | P27487 | 5/20 | 0.33 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.32 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6119348 | 0.84 | AKT1 (0.38) | CA2CHKARPS6KB1AKT1RIPK1 | |
| SCHEMBL24027079 | 0.80 | PSEN1 (0.39) | MAP4K4ACACB | |
| SCHEMBL26975070 | 0.77 | AKT1 (0.38) | MAP4K4CA2CHKARPS6KB1AKT1 | |
| SCHEMBL792633 | 0.77 | EGLN2 (0.40) | CA2CHKARPS6KB1AKT1RIPK1 | |
| SCHEMBL10187294 | 0.75 | SMPD3 (0.41) | RPS6KB1AKT1RIPK1BTKDPP4 | |
| SCHEMBL10187281 | 0.73 | LRRK2 (0.42) | MAP4K4AKT1DPP4 | |
| SCHEMBL23294851 | 0.73 | LRRK2 (0.41) | RPS6KB1AKT1RIPK1BTKDPP4 | |
| SCHEMBL12650637 | 0.73 | HRH3 (0.51) | BTK | |
| SCHEMBL23024963 | 0.72 | BTK (0.36) | RPS6KB1AKT1RIPK1BTKDPP4 | |
| SCHEMBL20732640 | 0.71 | SORD (0.41) | MAP4K4RIPK1DPP4DPP8 |
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 |