Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 3/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.31 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | HTR5A | P47898 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27381887 | 0.90 | P2RX7 (0.38) | P2RX7HSD17B1HSD17B2MEN1NPC1 | |
| SCHEMBL27382317 | 0.88 | HSD17B1 (0.35) | P2RX7HSD17B1HSD17B2MEN1NPC1 | |
| SCHEMBL27381789 | 0.87 | HSD17B1 (0.33) | HSD17B1HSD17B2MEN1NPC1KMT2A | |
| SCHEMBL19622706 | 0.86 | HTR6 (0.31) | CYP1B1 | |
| SCHEMBL19007621 | 0.85 | P2RX7 (0.43) | P2RX7MEN1NPC1KMT2ACYP1A2 | |
| SCHEMBL24782627 | 0.84 | P2RX7 (0.32) | P2RX7MEN1KMT2ACYP1B1 | |
| SCHEMBL22901166 | 0.84 | PLA2G2A (0.33) | CYP1A1CYP1A2 | |
| SCHEMBL18253718 | 0.84 | P2RX7 (0.38) | P2RX7MEN1NPC1KMT2ACYP1A2 | |
| SCHEMBL27381794 | 0.84 | ALDH1A1 (0.32) | HSD17B1HSD17B2MEN1NPC1KMT2A | |
| SCHEMBL22901082 | 0.83 | — | — |
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-2024080655-A1 | COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE HAVING SAME | 덕산네오룩스 주식회사 | 2024-04-18 | — | — | WO | disclosed |