Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 14/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 12/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | G6PD | P11413 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL9746094 | 0.98 | TP53 (0.43) | TP53TDP1ESR1ESR2PDE10A | |
| SCHEMBL136578 | 0.77 | CA1 (0.44) | ESR1ESR2KDM4EALDH1A1CYP1A2 | |
| SCHEMBL134940 | 0.75 | ACHE (0.44) | ESR1ESR2KDM4EALDH1A1CYP1A2 | |
| SCHEMBL107172 | 0.69 | ALDH1A1 (0.42) | ESR1ESR2KDM4EALDH1A1CYP1A2 | |
| SCHEMBL135460 | 0.69 | ACHE (0.42) | TDP1ALDH1A1ALOX12 | |
| SCHEMBL133003 | 0.67 | ALDH1A1 (0.40) | ESR1ESR2KDM4EALDH1A1CYP1A2 | |
| Hydrochloric Acid SCHEMBL3916639 | 0.67 | ACHE (0.40) | TDP1ALDH1A1 | |
| SCHEMBL137128 | 0.67 | ACHE (0.40) | TDP1ALDH1A1 | |
| SCHEMBL4419486 | 0.67 | CA1 (0.34) | KDM4EALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2742099 | 0.67 | EGFR (0.40) | KDM4ECYP3A4MAPTPKMHPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011091228-A1 | LIQUID RADIATION CURABLE RESINS CAPABLE OF CURING INTO LAYERS WITH SELECTIVE VISUAL EFFECTS AND METHODS FOR THE USE THEREOF | DSM IP ASSETS B.V. (NL) | 2011-07-28 | — | — | WO | disclosed |