Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | LPL | P06858 | 1/20 | 0.37 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22958745 | 0.97 | MAPT (0.39) | GSTP1ESR1ESR2LPLLIPG | |
| SCHEMBL22958765 | 0.94 | MAPT (0.39) | GSTP1ESR1ESR2LPLLIPG | |
| SCHEMBL22958664 | 0.92 | ESR1 (0.36) | GSTP1ESR1ESR2LPLLIPG | |
| SCHEMBL22958764 | 0.91 | GSTP1 (0.37) | GSTP1ESR1ESR2LPLLIPG | |
| SCHEMBL22958776 | 0.90 | SMN1; SMN2 (0.38) | GSTP1ESR1ESR2LPLLIPG | |
| SCHEMBL22958662 | 0.89 | ESR1 (0.38) | GSTP1ESR1ESR2LPLLIPG | |
| SCHEMBL22958650 | 0.89 | ATM (0.33) | MAPTSMN1; SMN2KDM4ENPC1ALDH1A1 | |
| SCHEMBL22958651 | 0.87 | ATM (0.34) | MAPTSMN1; SMN2KDM4ENPC1ALDH1A1 | |
| SCHEMBL22958647 | 0.87 | PDE6D (0.33) | MAPTSMN1; SMN2KDM4ENPC1ALDH1A1 | |
| SCHEMBL22958731 | 0.87 | PDE6D (0.33) | MAPTSMN1; SMN2KDM4ENPC1ALDH1A1 |
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-20210043852-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2021-02-11 | — | — | US | disclosed |