Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 10/20 | 0.41 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.38 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | MLNR | O43193 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | CCKBR | P32239 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL16191043 | 0.84 | ACHE (0.41) | KIF11KCNN4ACHEESR1ESR2 | |
| SCHEMBL24029860 | 0.82 | KCNN4 (0.48) | KIF11KCNN4KCNE1KCNQ1ACHE | |
| SCHEMBL7929172 | 0.82 | KCNN4 (0.50) | KIF11KCNN4ACHEESR1ESR2 | |
| SCHEMBL16191248 | 0.80 | KCNN4 (0.50) | KIF11KCNN4ACHEESR1ESR2 | |
| SCHEMBL7940715 | 0.79 | KCNN4 (0.51) | KIF11KCNN4KCNE1KCNQ1ACHE | |
| SCHEMBL27969116 | 0.78 | KIF11 (0.43) | KIF11KCNN4OPRK1MDM4TP53 | |
| SCHEMBL11865400 | 0.78 | KIF11 (0.41) | KIF11KCNN4KCNE1KCNQ1ACHE | |
| SCHEMBL11598635 | 0.78 | KCNN4 (0.45) | KIF11KCNN4KCNE1KCNQ1CYP19A1 | |
| SCHEMBL7935323 | 0.77 | ACHE (0.43) | KIF11KCNN4KCNE1KCNQ1ACHE | |
| SCHEMBL7935562 | 0.76 | KIF11 (0.41) | KIF11KCNN4KCNE1KCNQ1ACHE |
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 |
|---|---|---|---|---|---|---|---|
| US-6242654-B1 | REACTING A PHENOLATE COMPOUND WITH AN ORGANIC FLUORINATING AGENT TO PREPARE A FLUORINE SUBSTITUTED AROMATIC COMPOUND | MITSUI CHEMICALS, INC. (JP) | 2001-06-05 | — | — | US | disclosed |
| EP-1013629-A1 | Preparation process of fluorine subsituted aromatic compound | Mitsui Chemicals, Inc. (JP) | 2000-06-28 | — | — | EP | disclosed |