Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 1/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 5/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | PRKCG | P05129 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | PRKACA | P17612 | 1/20 | 0.38 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | AKT2 | P31751 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15161102 | 0.95 | GRM4 (0.46) | GRM4CYP17A1CYP1A2S1PR1S1PR3 | |
| SCHEMBL18174730 | 0.95 | CYP17A1 (0.47) | GRM4CYP17A1CYP1A2DHODHABL1 | |
| SCHEMBL15161084 | 0.95 | CYP17A1 (0.47) | GRM4CYP17A1CYP1A2DHODHABL1 | |
| SCHEMBL18174753 | 0.93 | PIK3CA (0.45) | GRM4CYP17A1CYP1A2S1PR1S1PR3 | |
| SCHEMBL18174716 | 0.92 | PIK3CA (0.47) | GRM4CYP17A1CYP1A2CYP19A1RPS6KA3 | |
| SCHEMBL18174564 | 0.91 | GRM4 (0.49) | GRM4CYP17A1CYP1A2S1PR1S1PR3 | |
| SCHEMBL9613162 | 0.90 | TNF (0.43) | GRM4CYP17A1CYP1A2S1PR1S1PR3 | |
| SCHEMBL18174755 | 0.90 | DHODH (0.41) | GRM4CYP17A1CYP1A2S1PR1S1PR3 | |
| SCHEMBL10032186 | 0.89 | CYP11B1 (0.47) | CYP17A1CYP1A2CYP19A1CCNCCDK8 | |
| SCHEMBL15160978 | 0.89 | GRM4 (0.42) | GRM4CYP17A1CYP1A2S1PR1S1PR3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9478750-B2 | Anthracene derivative and organic electroluminescent element using the same | JNC CORPORATION (JP) | 2016-10-25 | — | — | US | disclosed |
| US-9478750-B2 | Anthracene derivative and organic electroluminescent element using the same | JNC CORPORATION (JP) | 2016-10-25 | — | — | US | disclosed |