Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.31 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28259498 | 0.85 | ALDH1A1 (0.41) | ALDH1A1TSHRMEN1LMNATHRB | |
| SCHEMBL28690581 | 0.83 | SRC (0.37) | ALDH1A1TSHRKCNJ1MEN1LMNA | |
| SCHEMBL6851211 | 0.82 | TDP1 (0.41) | ALDH1A1TSHRMEN1LMNATHRB | |
| SCHEMBL28814438 | 0.80 | ESR1 (0.40) | MEN1KMT2AL3MBTL1NPC1RAB9A | |
| SCHEMBL9310987 | 0.79 | NOS3 (0.31) | NOS3NOS2 | |
| SCHEMBL28208146 | 0.79 | ALDH1A1 (0.36) | ALDH1A1TSHRKCNJ1MEN1KMT2A | |
| SCHEMBL28664021 | 0.79 | KDM4E (0.37) | ALDH1A1TSHRNOS3NOS2GAA | |
| Ammonia Solution, Strong SCHEMBL22472015 | 0.78 | — | — | |
| SCHEMBL27578476 | 0.76 | NOS2 (0.40) | ALDH1A1TSHRMEN1LMNATHRB | |
| SCHEMBL28866503 | 0.75 | ALDH1A1 (0.35) | ALDH1A1TSHRLMNACYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6562996-B2 | Alkyl aromatic aldehydes | EXXONMOBIL CHEMICAL PATENTS INC. | 2003-05-13 | — | — | US | disclosed |
| WO-2003016252-A2 | ALKYL AROMATIC ALDEHYDES | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2003-02-27 | — | — | WO | disclosed |
| US-20020068841-A1 | Alkyl aromatic aldehydes | EXXONMOBIL CHEMICAL PATENTS INC. | 2002-06-06 | — | — | US | disclosed |