Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 9/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23937529 | 1.00 | PGR (0.42) | PGRCYP1A2MEN1ALDH1A1KMT2A | |
| SCHEMBL23937413 | 1.00 | PGR (0.42) | PGRCYP1A2MEN1ALDH1A1KMT2A | |
| SCHEMBL23937412 | 1.00 | PGR (0.42) | PGRCYP1A2MEN1ALDH1A1KMT2A | |
| SCHEMBL23937404 | 0.99 | PGR (0.43) | PGRCYP1A2MEN1ALDH1A1KMT2A | |
| SCHEMBL23937395 | 0.99 | CYP1A2 (0.42) | PGRCYP1A2MEN1ALDH1A1KMT2A | |
| SCHEMBL23937398 | 0.98 | PGR (0.41) | PGRCYP1A2MEN1ALDH1A1KMT2A | |
| SCHEMBL23937525 | 0.95 | PGR (0.45) | PGRCYP1A2MEN1ALDH1A1KMT2A | |
| SCHEMBL23937518 | 0.95 | PGR (0.45) | PGRCYP1A2MEN1ALDH1A1KMT2A | |
| SCHEMBL23937533 | 0.95 | PGR (0.45) | PGRCYP1A2MEN1ALDH1A1KMT2A | |
| SCHEMBL23937523 | 0.95 | PGR (0.45) | PGRCYP1A2MEN1ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3896061-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME | Solus Advanced Materials Co., Ltd. (KR) | 2021-10-20 | — | — | EP | disclosed |