Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | DGKA | P23743 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27768690 | 0.81 | ALDH1A1 (0.50) | ALDH1A1CYP2D6CA1CYP1A2LMNA | |
| SCHEMBL3588443 | 0.75 | ALDH1A1 (0.50) | ALDH1A1CYP2D6CA1LMNAHSD17B10 | |
| SCHEMBL29043168 | 0.75 | CES1 (0.58) | ALDH1A1CES1CES2TP53CA1 | |
| SCHEMBL28528118 | 0.74 | TSHR (0.61) | ALDH1A1CES1CES2DGKAFAAH | |
| SCHEMBL8844675 | 0.74 | — | — | |
| SCHEMBL10963692 | 0.74 | ALDH1A1 (0.52) | ALDH1A1CYP2D6CA1LMNAHSD17B10 | |
| SCHEMBL22438530 | 0.72 | ALDH1A1 (0.46) | ALDH1A1CES1CES2TP53CA1 | |
| SCHEMBL28079755 | 0.70 | CYP1A2 (0.61) | ALDH1A1CES1CES2DGKACYP1A2 | |
| SCHEMBL28393816 | 0.69 | ALDH1A1 (0.47) | ALDH1A1CYP2D6CA1CYP1A2LMNA | |
| SCHEMBL10890938 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2061820-A1 | BLOCK COPOLYMER, PROCESS FOR MAKING THE SAME, AND USE IN EMULSIONS | Rhodia Opérations (FR) | 2009-05-27 | — | — | EP | disclosed |
| WO-2008019984-A1 | BLOCK COPOLYMER, PROCESS FOR MAKING THE SAME, AND USE IN EMULSIONS | RHODIA OPERATIONS (FR) | 2008-02-21 | — | — | WO | disclosed |