Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.53 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 2/20 | 0.43 |
| ▸ | THRA | P10827 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1831207 | 1.00 | EPHX2 (0.53) | EPHX2PAOXGAAKDM4ETDP1 | |
| SCHEMBL1830494 | 1.00 | EPHX2 (0.53) | EPHX2PAOXGAAKDM4ETDP1 | |
| SCHEMBL5843494 | 0.87 | KDM4E (0.57) | PAOXGAAKDM4ETDP1SMN1; SMN2 | |
| SCHEMBL1726737 | 0.87 | KDM4E (0.57) | PAOXGAAKDM4ETDP1SMN1; SMN2 | |
| SCHEMBL30701340 | 0.87 | KDM4E (0.57) | PAOXGAAKDM4ETDP1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5843429 | 0.85 | GLA (0.56) | PAOXGAAKDM4ETDP1SMN1; SMN2 | |
| SCHEMBL8616993 | 0.85 | KDM4E (0.59) | PAOXGAAKDM4ESMN1; SMN2GLA | |
| SCHEMBL1358701 | 0.83 | KDM4E (0.61) | PAOXGAAKDM4ESMN1; SMN2GLA | |
| Hydrochloric Acid SCHEMBL11543248 | 0.81 | GLA (0.60) | PAOXGAAKDM4ESMN1; SMN2GLA | |
| SCHEMBL23471239 | 0.80 | KEAP1 (0.66) | EPHX2KDM4ESMN1; SMN2KEAP1ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2342181-A1 | NOVEL UREA AND THIOUREA DERIVATIVES | Topo Target A/S (DK) | 2011-07-13 | — | — | EP | disclosed |
| EP-2318369-A1 | SQUARIC ACID DERIVATIVES AS INHIBITORS OF THE NICOTINAMIDE | TopoTarget A/S (DK) | 2011-05-11 | — | — | EP | disclosed |
| WO-2010066709-A1 | NOVEL PYRIDINYL ACRYLAMIDE DERIVATIVES | TOPOTARGET A/S (DK) | 2010-06-17 | — | — | WO | disclosed |
| WO-2010023307-A1 | NOVEL UREA AND THIOUREA DERIVATIVES | TOPOTARGET A/S (DK) | 2010-03-04 | — | — | WO | disclosed |