Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 3/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.36 |
| ▸ | USP2 | O75604 | 3/20 | 0.36 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29863425 | 0.81 | BRD4 (0.39) | NAMPTBRD4CREBBPMAPK1SMN1; SMN2 | |
| SCHEMBL4880946 | 0.77 | BRD4 (0.45) | NAMPTBRD4CREBBPALDH1A1MAPK1 | |
| SCHEMBL5822563 | 0.75 | BRD4 (0.42) | BRD4CREBBPALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL30125059 | 0.75 | BRD4 (0.42) | BRD4CREBBPALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL29491264 | 0.67 | BRD4 (0.41) | NAMPTBRD4CREBBPALDH1A1CYP1A2 | |
| SCHEMBL25422279 | 0.65 | BRD4 (0.39) | BRD4CREBBPALDH1A1CYP1A2MAPK1 | |
| SCHEMBL3458566 | 0.65 | ALDH1A1 (0.41) | NAMPTALDH1A1CYP1A2CYP2D6SMN1; SMN2 | |
| Indoline SCHEMBL8922922 | 0.64 | MAPK1 (0.40) | BRD4ALDH1A1CYP1A2MAPK1SMN1; SMN2 | |
| SCHEMBL13239096 | 0.63 | BRD4 (0.52) | BRD4CREBBPALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL27881241 | 0.63 | BRD4 (0.43) | BRD4CREBBPALDH1A1CYP1A2MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114901279-A | Inhibitors of cGAS for the treatment of autoinflammatory diseases and cancer metastasis | 洛克菲勒大学 | 2022-08-12 | — | — | CN | disclosed |