Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 10/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.36 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 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 | |
|---|---|---|---|---|
| SCHEMBL20114544 | 1.00 | ABCG2 (0.40) | ABCG2ABCB1MEN1ALDH1A1CYP1A2 | |
| SCHEMBL20114555 | 0.99 | ABCG2 (0.41) | ABCG2ABCB1MEN1ALDH1A1CYP1A2 | |
| SCHEMBL27016016 | 0.98 | ABCG2 (0.41) | ABCG2ABCB1MEN1ALDH1A1CYP1A2 | |
| SCHEMBL27016021 | 0.97 | ABCG2 (0.40) | ABCG2ABCB1MEN1ALDH1A1CYP1A2 | |
| SCHEMBL21742003 | 0.97 | PTGER4 (0.39) | ABCG2ABCB1MEN1ALDH1A1CYP1A2 | |
| SCHEMBL20114541 | 0.97 | PTGER4 (0.39) | ABCG2ABCB1MEN1ALDH1A1CYP1A2 | |
| SCHEMBL20114634 | 0.96 | CYP1A2 (0.41) | ABCG2ABCB1MEN1ALDH1A1CYP1A2 | |
| SCHEMBL27020079 | 0.96 | CYP1A2 (0.42) | ABCG2ABCB1MEN1ALDH1A1CYP1A2 | |
| SCHEMBL20114571 | 0.96 | PTGER4 (0.40) | ABCG2ABCB1MEN1ALDH1A1CYP1A2 | |
| SCHEMBL20114688 | 0.95 | CYP1A2 (0.44) | ABCG2ABCB1MEN1ALDH1A1CYP1A2 |
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-2020035495-A1 | ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2020-02-20 | — | — | WO | disclosed |