Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.31 |
| ▸ | APBA1 | Q02410 | 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 | |
|---|---|---|---|---|
| SCHEMBL10363917 | 0.79 | TDP1 (0.34) | TDP1TSHRCYP3A4 | |
| SCHEMBL3220847 | 0.77 | — | — | |
| SCHEMBL17801423 | 0.75 | — | — | |
| SCHEMBL1709089 | 0.75 | — | — | |
| SCHEMBL9861953 | 0.74 | TDP1 (0.32) | TDP1TSHR | |
| SCHEMBL12723411 | 0.73 | — | — | |
| SCHEMBL9804393 | 0.71 | TDP1 (0.43) | TDP1CA1CA2MEN1POLB | |
| SCHEMBL5873282 | 0.71 | TDP1 (0.61) | TDP1CA1CA2MEN1KMT2A | |
| SCHEMBL911033 | 0.71 | — | — | |
| SCHEMBL6557169 | 0.71 | TSHR (0.40) | TDP1CA1CA2MEN1POLB |
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-2004074303-A2 | REAGENTS AND METHODS FOR PREPARING LPS ANTAGONIST B1287 AND STEREOISOMERS THEREOF | EISAI CO, LTD. (JP) | 2004-09-02 | — | — | WO | disclosed |