Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL11292001 | 1.00 | ALDH1A1 (0.39) | ALDH1A1HSD17B10TSHRTDP1THRB | |
| SCHEMBL9802784 | 0.95 | ALDH1A1 (0.39) | ALDH1A1HSD17B10TSHRTDP1THRB | |
| SCHEMBL1450274 | 0.93 | ALDH1A1 (0.40) | ALDH1A1HSD17B10TSHRTDP1THRB | |
| SCHEMBL5980539 | 0.92 | ALDH1A1 (0.54) | ALDH1A1HSD17B10TSHRTDP1THRB | |
| SCHEMBL8537650 | 0.92 | ALDH1A1 (0.54) | ALDH1A1HSD17B10TSHRTDP1THRB | |
| SCHEMBL9488328 | 0.92 | ALDH1A1 (0.54) | ALDH1A1HSD17B10TSHRTDP1THRB | |
| SCHEMBL11515665 | 0.88 | ALDH1A1 (0.33) | ALDH1A1TSHR | |
| SCHEMBL3911391 | 0.87 | USP2 (0.51) | THRBUSP2HTT | |
| SCHEMBL28928722 | 0.87 | ALDH1A1 (0.52) | ALDH1A1HSD17B10TSHRTDP1THRB | |
| SCHEMBL11489974 | 0.85 | ALDH1A1 (0.50) | ALDH1A1HSD17B10TSHRTHRBHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011130455-A1 | DERMAL PHARMACEUTICAL COMPOSITIONS OF 1-METHYL-2',6'-PIPECOLOXYLIDIDE AND METHOD OF USE | BABUL NAJIB (US) | 2011-10-20 | — | — | WO | disclosed |
| EP-2273876-A2 | STABILIZED COMPOSITIONS OF ALKYLATING AGENTS AND METHODS OF USING SAME | Yaupon Therapeutics, Inc. (US) | 2011-01-19 | — | — | EP | disclosed |