Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 3/20 | 0.76 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.76 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | PYGL | P06737 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CASP6 | P55212 | 1/20 | 0.49 |
| ▸ | KLK7 | P49862 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.49 |
| ▸ | FABP7 | O15540 | 1/20 | 0.48 |
| ▸ | FABP3 | P05413 | 1/20 | 0.48 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1122275 | 1.00 | HSD17B1 (0.76) | HSD17B1HSD17B2ALDH1A1CYP1A2PKM | |
| SCHEMBL10724129 | 0.87 | HSD17B1 (0.62) | HSD17B1HSD17B2ALDH1A1CYP1A2PKM | |
| SCHEMBL15782656 | 0.84 | HSD17B1 (0.57) | HSD17B1HSD17B2ALDH1A1CYP1A2PYGL | |
| SCHEMBL28824840 | 0.84 | CASP6 (0.62) | HSD17B1HSD17B2ALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL8752038 | 0.83 | NT5E (0.62) | HSD17B1HSD17B2CYP1A2HSD17B10CASP6 | |
| SCHEMBL1807568 | 0.83 | HSD17B1 (0.55) | HSD17B1HSD17B2ALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL19355161 | 0.83 | HSD17B1 (0.55) | HSD17B1HSD17B2ALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL11900180 | 0.83 | CASP6 (0.68) | HSD17B1HSD17B2ALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL11594992 | 0.83 | HSD17B1 (0.55) | HSD17B1HSD17B2ALDH1A1CYP1A2PYGL | |
| SCHEMBL26885136 | 0.83 | HSD17B1 (0.55) | HSD17B1HSD17B2ALDH1A1PYGLHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112804982-B | Near infrared nerve-retaining benzo [ c ] phenoxazine fluorophores | 俄勒冈健康与科学大学 | 2023-07-25 | — | — | CN | disclosed |
| CN-114806216-A | High-salt-tolerance alkali-resistance reactive dye and preparation method thereof | 南京晓庄学院 | 2022-07-29 | — | — | CN | disclosed |