Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 2/20 | 0.46 |
| ▸ | AHR | P35869 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 3/20 | 0.44 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.44 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.44 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.44 |
| ▸ | OTUD7B | Q6GQQ9 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | HTR5A | P47898 | 4/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | HK1 | P19367 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30100699 | 0.81 | PDK2 (0.48) | PDK2AHRBRD4CREBBPNPC1 | |
| SCHEMBL6220027 | 0.81 | PDK2 (0.48) | PDK2AHRBRD4CREBBPNPC1 | |
| SCHEMBL23674847 | 0.75 | NPSR1 (0.52) | PDK2AHRBRD4CREBBPNPC1 | |
| SCHEMBL30100714 | 0.75 | NPSR1 (0.52) | PDK2AHRBRD4CREBBPNPC1 | |
| SCHEMBL13090519 | 0.74 | MAPT (0.42) | PDK2AHRBRD4CREBBPNPC1 | |
| SCHEMBL9194873 | 0.74 | PDK2 (0.42) | PDK2AHRBRD4CREBBPNPC1 | |
| SCHEMBL14941425 | 0.73 | OTUD7B (0.59) | PDK2AHRBRD4CREBBPNPC1 | |
| SCHEMBL30293249 | 0.73 | OTUD7B (0.59) | PDK2AHRBRD4CREBBPNPC1 | |
| SCHEMBL28394080 | 0.73 | PDK2 (0.48) | PDK2AHRBRD4CREBBPNPC1 | |
| SCHEMBL8524680 | 0.72 | AHR (0.57) | PDK2AHRBRD4CREBBPNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4757068-A | Lactams and bicyclic lactams useful as cholecystokinin antagonists | MERCK & CO., INC. (US) | 1988-07-12 | — | — | US | disclosed |