Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 4/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8017867 | 0.89 | ACHE (0.50) | HPGDACHETSHRLMNAALOX12 | |
| SCHEMBL2939094 | 0.84 | TDP1 (0.53) | HPGDTSHRLMNAALOX12TDP1 | |
| SCHEMBL12889884 | 0.79 | TDP1 (0.67) | HPGDACHETSHRLMNAALOX12 | |
| SCHEMBL49480 | 0.79 | TDP1 (0.67) | HPGDACHETSHRLMNAALOX12 | |
| SCHEMBL7661200 | 0.79 | TDP1 (0.67) | HPGDACHETSHRLMNAALOX12 | |
| SCHEMBL49680 | 0.79 | TDP1 (0.67) | HPGDACHETSHRLMNAALOX12 | |
| SCHEMBL10821217 | 0.77 | ESR1 (0.62) | HPGDACHETSHRLMNAALOX12 | |
| SCHEMBL16424434 | 0.77 | TDP1 (0.63) | HPGDACHETSHRLMNAALOX12 | |
| P-Xylene SCHEMBL10884475 | 0.76 | TDP1 (0.71) | HPGDACHETSHRLMNAALOX12 | |
| SCHEMBL2153490 | 0.75 | ACHE (0.48) | HPGDACHETSHRLMNAALOX12 |
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 |
|---|---|---|---|---|---|---|---|
| US-6031066-A | POLYMERIZING ALPHA, BETA-UNSATURATED CARBOXYLIC ACID ESTER CONTAINING A TERTIARY AMINO GROUP AS A POLYMERIZABLE MONOMER IN THE PRESENCE OF A PHOSPHORUS COMPOUND | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2000-02-29 | — | — | US | disclosed |