Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.31 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21345698 | 0.88 | ABCG2 (0.39) | ABCB1ABCG2MEN1ALDH1A1LMNA | |
| SCHEMBL25023752 | 0.86 | CYP1A2 (0.38) | ABCB1ABCG2MEN1ALDH1A1LMNA | |
| SCHEMBL21345685 | 0.84 | ABCG2 (0.41) | ABCB1ABCG2MEN1ALDH1A1LMNA | |
| SCHEMBL21345686 | 0.81 | CYP1A2 (0.42) | ABCG2MEN1ALDH1A1LMNACYP1A2 | |
| SCHEMBL22523971 | 0.81 | ABCG2 (0.41) | ABCB1ABCG2MEN1ALDH1A1LMNA | |
| SCHEMBL22544968 | 0.81 | ABCG2 (0.42) | ABCB1ABCG2 | |
| SCHEMBL23623331 | 0.79 | MEN1 (0.40) | ABCB1ABCG2MEN1ALDH1A1LMNA | |
| SCHEMBL21345680 | 0.79 | LIMK1 (0.36) | MEN1ALDH1A1LMNAKMT2AADORA2A | |
| SCHEMBL21345682 | 0.78 | LIMK1 (0.35) | MEN1ALDH1A1KMT2AADORA2AADORA1 | |
| SCHEMBL22523974 | 0.77 | CYP1A2 (0.42) | ABCG2MEN1ALDH1A1LMNACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019172652-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2019-09-12 | — | — | WO | disclosed |