Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESRRA | P11474 | 6/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | TTR | P02766 | 1/20 | 0.45 |
| ▸ | FDPS | P14324 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.43 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.43 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.43 |
| ▸ | ABAT | P80404 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2382859 | 0.95 | ESRRA (0.64) | ESRRACYP3A4ALDH1A1TSHRTTR | |
| SCHEMBL31512638 | 0.84 | ESRRA (0.47) | ESRRACYP3A4ALDH1A1TSHRTTR | |
| SCHEMBL5541338 | 0.80 | ESRRA (0.61) | ESRRAALDH1A1TSHRTTRMAPT | |
| SCHEMBL31512634 | 0.80 | ESRRA (0.44) | ESRRACYP3A4ALDH1A1TTRGAA | |
| SCHEMBL2699247 | 0.80 | ESRRA (0.64) | ESRRACYP3A4ALDH1A1TSHRTTR | |
| SCHEMBL7366005 | 0.80 | ALDH1A1 (0.84) | ALDH1A1TSHRTTRFDPSGAA | |
| SCHEMBL6857313 | 0.79 | L3MBTL1 (0.57) | ESRRACYP3A4ALDH1A1TSHRTTR | |
| SCHEMBL2382784 | 0.79 | ESRRA (0.64) | ESRRACYP3A4ALDH1A1TSHRTTR | |
| SCHEMBL8158714 | 0.78 | ESRRA (0.52) | ESRRACYP3A4ALDH1A1GAAMAPT | |
| SCHEMBL29885821 | 0.78 | CYP3A4 (0.48) | ESRRACYP3A4ALDH1A1MAPTRAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009115874-A2 | NOVEL HETEROCYCLIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION | MATRIX LABORATORIES LTD. (IN) | 2009-09-24 | — | — | WO | disclosed |
| WO-2009115874-A2 | NOVEL HETEROCYCLIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION | MATRIX LABORATORIES LTD. (IN) | 2009-09-24 | — | — | WO | disclosed |