Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.38 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18055161 | 0.94 | SIGMAR1 (0.41) | SIGMAR1CYP1A2CYP2A6ALDH1A1HSD17B10 | |
| SCHEMBL7800521 | 0.92 | SIGMAR1 (0.40) | SIGMAR1CYP1A2CYP2A6ALDH1A1HSD17B10 | |
| SCHEMBL10128572 | 0.91 | SIGMAR1 (0.39) | SIGMAR1CYP1A2CYP2A6ALDH1A1HSD17B10 | |
| SCHEMBL13720938 | 0.91 | SIGMAR1 (0.39) | SIGMAR1CYP1A2CYP2A6ALDH1A1HSD17B10 | |
| SCHEMBL13721132 | 0.91 | SIGMAR1 (0.39) | SIGMAR1CYP1A2CYP2A6ALDH1A1HSD17B10 | |
| SCHEMBL6283489 | 0.86 | CYP1A2 (0.46) | SIGMAR1CYP1A2CYP2A6ALDH1A1HSD17B10 | |
| SCHEMBL14570738 | 0.86 | SIGMAR1 (0.43) | SIGMAR1CYP1A2CYP2A6ALDH1A1HSD17B10 | |
| SCHEMBL13367461 | 0.85 | SIGMAR1 (0.45) | SIGMAR1CYP1A2CYP2A6ALDH1A1HSD17B10 | |
| SCHEMBL29555114 | 0.84 | ACHE (0.39) | SIGMAR1CYP1A2ALDH1A1HSD17B10HPGD | |
| SCHEMBL2537211 | 0.84 | ACHE (0.39) | SIGMAR1CYP1A2ALDH1A1HSD17B10HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6929872-B2 | Organic electroluminescent devices | NIPPON STEEL CHEMICAL CO., LTD. (JP) | 2005-08-16 | — | — | US | disclosed |
| US-20040028944-A1 | Organic electroluminescent devices | NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) | 2004-02-12 | — | — | US | disclosed |