Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 9/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.37 |
| ▸ | MEN1 | O00255 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16809513 | 0.87 | ABCG2 (0.41) | ABCG2PDE4DPDE4APDE4CCYP1A2 | |
| SCHEMBL16809533 | 0.86 | ABCG2 (0.41) | ABCG2PDE4DPDE4APDE4CCYP1A2 | |
| SCHEMBL16809509 | 0.84 | CYP1A2 (0.41) | ABCG2CYP1A2CYP3A4MEN1ALDH1A1 | |
| SCHEMBL16809795 | 0.84 | ABCG2 (0.40) | ABCG2PDE4DPDE4APDE4CCYP1A2 | |
| SCHEMBL16809578 | 0.82 | FABP1 (0.40) | ABCG2PDE4DPDE4APDE4CCYP1A2 | |
| SCHEMBL16809572 | 0.81 | CYP1A2 (0.45) | ABCG2CYP1A2CYP3A4MEN1ALDH1A1 | |
| SCHEMBL16809862 | 0.80 | CYP1A2 (0.41) | ABCG2CYP1A2CYP3A4MEN1ALDH1A1 | |
| SCHEMBL16809541 | 0.80 | CYP1A2 (0.41) | ABCG2CYP1A2CYP3A4MEN1ALDH1A1 | |
| SCHEMBL23347677 | 0.80 | ABCG2 (0.39) | ABCG2PDE4DPDE4APDE4CCYP1A2 | |
| SCHEMBL16809606 | 0.80 | HTR1A (0.40) | ABCG2PDE4DPDE4APDE4CMEN1 |
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-9705088-B2 | Triazine-based compounds and organic light-emitting devices including triazine-based compounds | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-07-11 | — | — | US | disclosed |
| US-20150171336-A1 | TRIAZINE-BASED COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES INCLUDING TRIAZINE-BASED COMPOUNDS | SAMSUNG DISPLAY CO., LTD. (KR) | 2015-06-18 | — | — | US | disclosed |