Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27255578 | 0.94 | MCL1 (0.34) | NPC1RAB9AMCL1ESR1ESR2 | |
| SCHEMBL27345472 | 0.80 | NPC1 (0.41) | NPC1RAB9AALDH1A1KDM4ELMNA | |
| SCHEMBL19007184 | 0.78 | P2RX7 (0.46) | NPC1RAB9AALDH1A1P2RX7HPGD | |
| SCHEMBL18561430 | 0.77 | P2RX7 (0.41) | NPC1RAB9AALDH1A1KDM4EP2RX7 | |
| SCHEMBL24634495 | 0.77 | MCL1 (0.34) | NPC1RAB9AMCL1ESR1ESR2 | |
| SCHEMBL22842029 | 0.77 | ABL1 (0.33) | NPC1RAB9AMCL1ESR2ALDH1A1 | |
| SCHEMBL22841896 | 0.77 | NPC1 (0.35) | NPC1RAB9A | |
| SCHEMBL27364755 | 0.76 | NPC1 (0.41) | NPC1RAB9AALDH1A1KDM4ELMNA | |
| SCHEMBL27381887 | 0.75 | P2RX7 (0.38) | NPC1ESR1ESR2ALDH1A1KDM4E | |
| SCHEMBL21159977 | 0.75 | NPC1 (0.46) | NPC1RAB9AP2RX7 |
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-2024144180-A1 | COMPOSITION FOR OPTOELECTRONIC DEVICE AND ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE | 삼성에스디아이 주식회사 | 2024-07-04 | — | — | WO | disclosed |