Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 11/20 | 0.48 |
| ▸ | KMO | O15229 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28479488 | 0.83 | CYP1A2 (0.52) | KMOMAPK14ADORA2AADORA1CYP1A2 | |
| SCHEMBL10939790 | 0.80 | CYP1A2 (0.58) | KMOMAPK14MAOBCYP1A2ALOX15 | |
| SCHEMBL28853223 | 0.80 | L3MBTL1 (0.48) | GRM5MAPK14ADORA2AADORA1CYP1A2 | |
| SCHEMBL31245782 | 0.77 | CYP2A6 (0.58) | ADORA2AADORA1MAOBLMNAHPGD | |
| SCHEMBL15588908 | 0.77 | CYP2A6 (0.58) | ADORA2AADORA1MAOBLMNAHPGD | |
| SCHEMBL3600301 | 0.72 | CDC25A (0.56) | LMNAKMT2AL3MBTL1 | |
| SCHEMBL23809628 | 0.71 | ASIC3 (0.59) | GRM5KMOFAAH | |
| SCHEMBL31497087 | 0.70 | KMT2A (0.50) | ADORA2AADORA1MAOBCYP1A2CYP2C19 | |
| SCHEMBL15308225 | 0.70 | L3MBTL1 (0.69) | ADORA2AADORA1LMNAHPGDKMT2A | |
| SCHEMBL18098248 | 0.70 | LIMK1 (0.48) | GRM5KMOFAAHMAOBCYP1A2 |
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-105579445-A | Heterocyclic compound and organic light emitting device including the same | LG CHEMICAL LTD | 2016-05-11 | — | — | CN | disclosed |