Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD44 | P16070 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 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 | |
|---|---|---|---|---|
| SCHEMBL6254408 | 0.84 | AOC3 (0.43) | AOC3ALDH1A1CYP3A4TSHRHPGD | |
| SCHEMBL10700706 | 0.78 | ALDH1A1 (0.44) | CD44ALDH1A1CYP3A4TSHRHPGD | |
| SCHEMBL21013115 | 0.71 | AOC3 (0.46) | AOC3ALDH1A1CYP3A4TSHRHPGD | |
| SCHEMBL1772183 | 0.71 | AOC3 (0.42) | AOC3ALDH1A1CYP3A4HSD17B10TDP1 | |
| SCHEMBL9614284 | 0.70 | CHEK1 (0.50) | CD44ALDH1A1CYP3A4TSHRHPGD | |
| SCHEMBL28449120 | 0.69 | ALDH1A1 (0.37) | ALDH1A1GAA | |
| SCHEMBL23458394 | 0.69 | SIGMAR1 (0.47) | AOC3ALDH1A1HPGDTDP1GAA | |
| SCHEMBL29862168 | 0.69 | SIGMAR1 (0.47) | AOC3ALDH1A1HPGDTDP1GAA | |
| SCHEMBL6880366 | 0.68 | AOC3 (0.43) | AOC3ALDH1A1CYP3A4TSHRHPGD | |
| SCHEMBL16538202 | 0.68 | ALDH1A1 (0.31) | ALDH1A1GAA |
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-11384246-B2 | Near infrared absorbing dye, optical filter, and imaging device | AGC Inc. (JP) | 2022-07-12 | — | — | US | disclosed |
| US-20200148884-A1 | NEAR INFRARED ABSORBING DYE, OPTICAL FILTER, AND IMAGING DEVICE | AGC Inc. (JP) | 2020-05-14 | — | — | US | disclosed |