Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | FUT7 | Q11130 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15299942 | 0.93 | ALDH1A1 (0.50) | KDM4EALDH1A1CA12CA1CA2 | |
| SCHEMBL1174688 | 0.87 | TPMT (0.50) | KDM4EALDH1A1CA12CA1CA2 | |
| SCHEMBL26730188 | 0.79 | CA12 (0.55) | KDM4EALDH1A1CA12CA1CA2 | |
| SCHEMBL7234945 | 0.79 | CA12 (0.60) | KDM4EALDH1A1CA12CA1CA2 | |
| SCHEMBL9121827 | 0.79 | CA12 (0.60) | KDM4EALDH1A1CA12CA1CA2 | |
| SCHEMBL14577650 | 0.79 | ALDH1A1 (0.56) | KDM4EALDH1A1CA12CA1CA2 | |
| Methyl Alcohol SCHEMBL28269742 | 0.77 | CA12 (0.58) | KDM4EALDH1A1CA12CA1CA2 | |
| SCHEMBL166126 | 0.76 | TPMT (0.64) | KDM4EALDH1A1CA12CA1CA2 | |
| SCHEMBL7232930 | 0.76 | CA12 (0.52) | KDM4EALDH1A1CA12CA1CA2 | |
| SCHEMBL7232517 | 0.76 | CYP3A4 (0.53) | KDM4EALDH1A1CA12CA1CA2 |
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-2013149996-A9 | SUBSTITUTED TRICYCLIC COMPOUNDS WITH ACTIVITY TOWARDS EP1 RECEPTORS | ALMIRALL, S.A. (ES) | 2014-02-20 | — | — | WO | disclosed |