Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.50 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.48 |
| ▸ | CDK4 | P11802 | 2/20 | 0.46 |
| ▸ | CCND1 | P24385 | 2/20 | 0.46 |
| ▸ | PLG | P00747 | 1/20 | 0.46 |
| ▸ | PLAU | P00749 | 1/20 | 0.46 |
| ▸ | DHFR | P00374 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 2/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.42 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30960425 | 0.95 | ESR1 (0.54) | ESR1ESR2CDK4CCND1PLG | |
| SCHEMBL3695546 | 0.95 | ESR1 (0.54) | ESR1ESR2CDK4CCND1PLG | |
| SCHEMBL28847737 | 0.91 | ESR1 (0.53) | ESR1ESR2HPRT1CDK4CCND1 | |
| SCHEMBL6559203 | 0.88 | ALDH1A1 (0.61) | ESR1ESR2HPRT1CDK4CCND1 | |
| SCHEMBL23759468 | 0.88 | MEN1 (0.47) | ESR1ESR2CDK4CCND1PLG | |
| SCHEMBL1615585 | 0.87 | ALDH1A1 (0.53) | ESR1ESR2DHFRALDH1A1ALOX5 | |
| SCHEMBL19336433 | 0.86 | HPRT1 (0.64) | ESR1ESR2HPRT1ALDH1A1HIF1A | |
| SCHEMBL3005121 | 0.85 | ESR1 (0.56) | ESR1ESR2HPRT1DHFRALDH1A1 | |
| SCHEMBL19336383 | 0.85 | HPRT1 (0.70) | HPRT1ALDH1A1HIF1ACYP1B1HSD17B10 | |
| SCHEMBL383544 | 0.85 | HPRT1 (0.70) | HPRT1ALDH1A1HIF1ACYP1B1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-9812646-B2 | Organic compound and organic light-emitting device and display apparatus having the same | CANON KABUSHIKI KAISHA (JP) | 2017-11-07 | — | — | US | disclosed |