Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.33 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL16429694 | 0.82 | TDP1 (0.44) | TDP1TSHRCYP3A4MAPTCACNA1B | |
| SCHEMBL13291369 | 0.79 | TDP1 (0.46) | TDP1TSHRCYP3A4MAPTCACNA1B | |
| SCHEMBL14977278 | 0.79 | TSHR (0.40) | TDP1TSHRCYP3A4MAPTCACNA1B | |
| SCHEMBL9283778 | 0.78 | TDP1 (0.44) | TDP1TSHRCYP3A4MAPTCACNA1B | |
| SCHEMBL1934657 | 0.78 | TSHR (0.44) | TDP1TSHRCYP3A4MAPTCACNA1B | |
| SCHEMBL9635138 | 0.78 | TSHR (0.44) | TDP1TSHRCYP3A4MAPTCACNA1B | |
| SCHEMBL367625 | 0.77 | — | — | |
| SCHEMBL366726 | 0.77 | — | — | |
| SCHEMBL5082863 | 0.77 | ALDH1A1 (0.42) | TSHRABCB1ALDH1A1HSD17B10 | |
| SCHEMBL35945 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-3101675-A | — | — | None | — | — | JP | disclosed |
| JP-H03101675-A | PREPARATION OF (2S,3R,1'S)-STEGOBINONE AND (2S,3R,1'R,2'R)-STEGOBIOL | JAPAN TOBACCO INC | 1991-04-26 | — | — | JP | disclosed |