Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.56 |
| ▸ | CA2 | P00918 | 4/20 | 0.56 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CLK1 | P49759 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL819485 | 0.86 | CA1 (0.56) | CA1CA2XDHSLC22A12ALDH1A1 | |
| SCHEMBL29482237 | 0.86 | CA1 (0.56) | CA1CA2XDHSLC22A12ALDH1A1 | |
| SCHEMBL7304752 | 0.79 | CA1 (0.61) | CA1CA2XDHSLC22A12ALDH1A1 | |
| SCHEMBL11714367 | 0.77 | CA1 (0.51) | CA1CA2XDHSLC22A12ALDH1A1 | |
| SCHEMBL1920403 | 0.74 | POLB (0.47) | CA1CA2ALDH1A1KDM4ETSHR | |
| SCHEMBL23087600 | 0.73 | CA1 (0.59) | CA1CA2XDHSLC22A12ALDH1A1 | |
| SCHEMBL2185041 | 0.73 | NQO2 (0.55) | CA1CA2XDHSLC22A12ALDH1A1 | |
| SCHEMBL3970625 | 0.73 | CYP1A2 (0.55) | CA1CA2XDHSLC22A12ALDH1A1 | |
| SCHEMBL21178065 | 0.73 | CYP1A2 (0.55) | CA1CA2ALDH1A1KDM4ECYP1B1 | |
| SCHEMBL4506751 | 0.73 | CYP2A6 (0.40) | CA1CA2ALDH1A1KDM4ECLK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1549615-B1 | NAPHTHAMIDE DERIVATIVES AND THEIR USE | ASTRAZENECA AB (SE) | 2008-12-03 | — | — | EP | disclosed |