Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 3/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 6/20 | 0.35 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 2/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19039832 | 0.79 | IRAK4 (0.46) | GRM5IRAK4DHODHTGFBR1MEN1 | |
| SCHEMBL22102810 | 0.75 | MCL1 (0.36) | GRM5ESR1ESR2MCL1DHODH | |
| SCHEMBL16189419 | 0.74 | IRAK4 (0.44) | GRM5IRAK4DHODHTGFBR1MEN1 | |
| SCHEMBL16189521 | 0.72 | IRAK4 (0.44) | GRM5IRAK4DHODHTGFBR1MEN1 | |
| SCHEMBL17932479 | 0.71 | MEN1 (0.55) | MCL1TGFBR1MEN1KMT2ACYP19A1 | |
| SCHEMBL19039833 | 0.71 | MEN1 (0.44) | GRM5IRAK4TGFBR1MEN1KMT2A | |
| SCHEMBL23193330 | 0.71 | MCL1 (0.38) | ESR1MCL1MEN1KMT2ACYP19A1 | |
| SCHEMBL25458684 | 0.70 | MCL1 (0.38) | MCL1MEN1KMT2ACYP19A1 | |
| SCHEMBL19009236 | 0.69 | CCR1 (0.54) | GRM5IRAK4TGFBR1MEN1KMT2A | |
| SCHEMBL17932367 | 0.69 | CYP19A1 (0.53) | MCL1DHODHTGFBR1MEN1KMT2A |
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-3188268-A1 | ORGANIC LIGHT-EMITTING DEVICE | Samsung Display Co., Ltd. (KR) | 2017-07-05 | — | — | EP | disclosed |