Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.34 |
| ▸ | APAF1 | O14727 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12048720 | 0.77 | TRPM4 (0.41) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL6287052 | 0.76 | TRPM4 (0.43) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL9888888 | 0.76 | TRPM4 (0.43) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL14069628 | 0.74 | TRPM4 (0.42) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL13720442 | 0.73 | ALDH1A1 (0.42) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL12333196 | 0.73 | ALDH1A1 (0.42) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL13721283 | 0.73 | ALDH1A1 (0.42) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL21763381 | 0.73 | TRPM4 (0.41) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL15730661 | 0.73 | ALDH1A1 (0.42) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL13271325 | 0.73 | TRPM4 (0.41) | TRPM4ALDH1A1HSD17B10HIF1ACYP1B1 |
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-3342774-B1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME | LG CHEMICAL LTD (KR) | 2021-06-23 | — | — | EP | disclosed |