Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20172086 | 0.89 | CYP1A2 (0.36) | CYP1A2CYP17A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17489963 | 0.84 | HSPA1A (0.39) | HSPA1APABPC1ADRA2AADRA2BADRA2C | |
| SCHEMBL17490040 | 0.82 | CYP1A2 (0.34) | CYP1A2CYP17A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL20308279 | 0.81 | ALDH1A1 (0.38) | CYP1A2CYP17A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL17490039 | 0.76 | CDK8 (0.37) | LMNARPS6KA5POLBALDH1A1FGFR1 | |
| SCHEMBL20172208 | 0.76 | ADRA2A (0.35) | HSPA1APABPC1LMNAADRA2AADRA2B | |
| SCHEMBL20172216 | 0.75 | ADRA2A (0.37) | HSPA1APABPC1LMNAADRA2AADRA2B | |
| SCHEMBL17489712 | 0.71 | CA12 (0.36) | CYP1A2CYP17A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL20308277 | 0.71 | ALDH1A1 (0.33) | CYP1A2CYP17A1CA12CA1CA2 | |
| SCHEMBL20308278 | 0.70 | CDK8 (0.37) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3339395-B1 | CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG ELECTRONICS CO LTD (KR) | 2019-10-02 | — | — | EP | disclosed |
| EP-2980182-B1 | CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG ELECTRONICS CO LTD (KR) | 2018-05-23 | — | — | EP | disclosed |