Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 5/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29418125 | 0.84 | ALDH1A1 (0.52) | DHFRALDH1A1HPGDKEAP1HSD17B10 | |
| SCHEMBL4915508 | 0.84 | ALDH1A1 (0.52) | DHFRALDH1A1HPGDKEAP1HSD17B10 | |
| SCHEMBL30267272 | 0.84 | DHFR (0.38) | DHFRALDH1A1HPGDKEAP1HSD17B10 | |
| SCHEMBL30791444 | 0.83 | ALDH1A1 (0.50) | DHFRALDH1A1HPGDKEAP1HSD17B10 | |
| SCHEMBL788001 | 0.80 | ALDH1A1 (0.56) | DHFRALDH1A1HPGDKEAP1HSD17B10 | |
| SCHEMBL29192702 | 0.80 | ALDH1A1 (0.47) | DHFRALDH1A1HPGDKEAP1HSD17B10 | |
| SCHEMBL31037940 | 0.80 | MEN1 (0.42) | DHFRALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL30471668 | 0.80 | MEN1 (0.42) | DHFRALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL1154289 | 0.80 | MEN1 (0.42) | DHFRALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL801379 | 0.80 | MEN1 (0.42) | DHFRALDH1A1HPGDHSD17B10TSHR |
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-2022199449-A1 | ORGANIC COMPOUND AND ELECTRONIC DEVICE COMPRISING SAME, AND ELECTRONIC APPARATUS | 陕西莱特光电材料股份有限公司 | 2022-09-29 | — | — | WO | disclosed |