Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TYR | P14679 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CA3 | P07451 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8779804 | 0.86 | KDM4E (0.38) | ALDH1A1KDM4ETDP1 | |
| SCHEMBL24384354 | 0.76 | NR1H2 (0.52) | NR1H2CYP3A4HSD17B10ALOX15HIF1A | |
| SCHEMBL7938138 | 0.74 | ALDH1A1 (0.36) | HSD17B10CA2MEN1ALDH1A1KMT2A | |
| SCHEMBL518852 | 0.74 | ALDH1A1 (0.58) | NR1H2CYP3A4HSD17B10ALOX15HIF1A | |
| SCHEMBL2480563 | 0.74 | NR1H2 (0.50) | NR1H2CYP3A4HSD17B10ALOX15HIF1A | |
| SCHEMBL8486201 | 0.74 | IDO1 (0.39) | ALDH1A1KDM4ETDP1 | |
| SCHEMBL15006816 | 0.73 | SRD5A2 (0.42) | LMNAHPGDALDH1A1MAPTESR1 | |
| SCHEMBL7071392 | 0.72 | NR1H2 (0.48) | NR1H2CYP3A4HSD17B10ALOX15HIF1A | |
| SCHEMBL8609684 | 0.72 | NR1H2 (0.48) | NR1H2CYP3A4HSD17B10ALOX15HIF1A | |
| SCHEMBL9018876 | 0.72 | TSHR (0.52) | ALOX15CA2TYRALDH1A1CA3 |
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 3 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 |
| CN-1263882-A | Method for preparing fluorine-substituted aromatic compound | MITSUI CHEMICALS INC (JP) | 2000-08-23 | — | — | CN | disclosed |
| EP-1013629-A1 | Preparation process of fluorine subsituted aromatic compound | Mitsui Chemicals, Inc. (JP) | 2000-06-28 | — | — | EP | disclosed |