Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 8/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.37 |
| ▸ | LCK | P06239 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21279070 | 0.97 | ABCG2 (0.45) | ABCG2ABCB1MEN1KMT2ACYP1A2 | |
| SCHEMBL22563499 | 0.93 | ABCG2 (0.43) | ABCG2ABCB1MEN1KMT2ACYP1A2 | |
| SCHEMBL21279106 | 0.93 | ABCG2 (0.43) | ABCG2ABCB1MEN1KMT2AALDH1A1 | |
| SCHEMBL21279103 | 0.92 | ABCG2 (0.40) | ABCG2ABCB1MEN1KMT2ACYP1A2 | |
| SCHEMBL21278970 | 0.92 | ALDH1A3 (0.43) | ABCG2MEN1KMT2ACYP1A2ALDH1A1 | |
| SCHEMBL21279054 | 0.91 | ABCG2 (0.39) | ABCG2ABCB1MEN1KMT2ACYP1A2 | |
| SCHEMBL21279055 | 0.91 | ABCG2 (0.39) | ABCG2ABCB1MEN1KMT2ACYP1A2 | |
| SCHEMBL21279006 | 0.90 | ABCG2 (0.38) | ABCG2ABCB1MEN1KMT2ACYP1A2 | |
| SCHEMBL21108013 | 0.90 | ABCG2 (0.42) | ABCG2ABCB1MEN1KMT2ACYP1A2 | |
| SCHEMBL22563431 | 0.90 | ABCG2 (0.44) | ABCG2ABCB1MEN1KMT2ACYP1A2 |
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-3399004-B1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-08-21 | — | — | EP | disclosed |