Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.56 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | ELANE | P08246 | 1/20 | 0.43 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7938157 | 0.87 | ESR2 (0.50) | ESR1ESR2APPMEN1KMT2A | |
| SCHEMBL7938528 | 0.81 | ESR2 (0.52) | ESR1ESR2APPMEN1KMT2A | |
| SCHEMBL7937271 | 0.81 | MEN1 (0.64) | ESR1ESR2ELANEMEN1KMT2A | |
| SCHEMBL7940685 | 0.80 | LMNA (0.41) | ELANEAPPKMT2AIDO1LMNA | |
| SCHEMBL7938063 | 0.80 | ESR1 (0.56) | ESR1ESR2PTPN1ELANE | |
| SCHEMBL3420523 | 0.80 | ESR1 (0.56) | ESR1ESR2PTPN1ELANECALM1 | |
| SCHEMBL14421265 | 0.76 | ESR1 (0.70) | ESR1ESR2PTPN1CALM1APP | |
| SCHEMBL5488305 | 0.76 | ESR1 (0.70) | ESR1ESR2PTPN1CALM1APP | |
| SCHEMBL12804905 | 0.76 | ESR1 (0.70) | ESR1ESR2PTPN1CALM1APP | |
| SCHEMBL7938025 | 0.76 | NR1H2 (0.56) | ESR1ESR2MEN1KMT2AKDM4E |
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 |