Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 5/20 | 0.53 |
| ▸ | RXRB | P28702 | 5/20 | 0.53 |
| ▸ | NR4A2 | P43354 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | RXRG | P48443 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3378535 | 0.80 | RXRA (0.56) | RXRARXRBNR4A2CYP1A2CYP3A4 | |
| SCHEMBL11620698 | 0.73 | NOTUM (0.54) | RXRARXRBMAPTALDH1A1RXRG | |
| SCHEMBL28691466 | 0.73 | MAPT (0.80) | MAPTCYP1A2CYP2D6CYP2C19HTT | |
| SCHEMBL29350219 | 0.73 | MAPT (0.80) | MAPTCYP1A2CYP2D6CYP2C19HTT | |
| SCHEMBL5098772 | 0.71 | NR4A2 (0.60) | RXRARXRBNR4A2ALDH1A1RXRG | |
| SCHEMBL4424839 | 0.70 | CES2 (0.61) | ALDH1A1CASP3 | |
| SCHEMBL6538823 | 0.69 | HPGD (0.53) | HTTALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL19835405 | 0.69 | MALT1 (0.51) | MAPTCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL19835670 | 0.69 | ALDH1A1 (0.46) | MAPTRECQLALDH1A1TSHRRXFP1 | |
| SCHEMBL8545123 | 0.69 | RXRA (0.57) | RXRARXRBNR4A2CYP3A4CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1966173-B1 | HETEROCYCLIC DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF | SANOFI AVENTIS (FR) | 2010-11-17 | — | — | EP | disclosed |
| EP-1966173-A2 | HETEROCYCLIC DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF | Sanofi-Aventis (FR) | 2008-09-10 | — | — | EP | disclosed |
| WO-2007068815-A2 | HETEROCYCLIC DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2007-06-21 | — | — | WO | disclosed |