Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPB1 | P04792 | 4/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6671840 | 0.90 | HSD17B10 (0.56) | POLBHSD11B1CA1CA2CA5A | |
| Ethane SCHEMBL28251595 | 0.83 | HSPB1 (0.69) | HSPB1POLBSMN1; SMN2HSD17B10ACHE | |
| SCHEMBL7026994 | 0.83 | HSPB1 (0.75) | HSPB1POLBSMN1; SMN2CA1CA2 | |
| SCHEMBL536 | 0.83 | HSPB1 (0.75) | HSPB1POLBSMN1; SMN2CA1CA2 | |
| SCHEMBL13176247 | 0.82 | ALDH1A1 (0.58) | POLBSMN1; SMN2NPC1RAB9AHSD11B1 | |
| Methyl Alcohol SCHEMBL28785209 | 0.81 | HSPB1 (0.67) | HSPB1POLBSMN1; SMN2NPC1RAB9A | |
| Water SCHEMBL28147677 | 0.81 | HSPB1 (0.72) | HSPB1POLBSMN1; SMN2NPC1RAB9A | |
| Fluoride SCHEMBL4551986 | 0.81 | HSPB1 (0.72) | HSPB1POLBSMN1; SMN2NPC1RAB9A | |
| Fluoride SCHEMBL4551988 | 0.81 | HSPB1 (0.72) | HSPB1POLBSMN1; SMN2NPC1RAB9A | |
| SCHEMBL28001935 | 0.81 | HSPB1 (0.72) | HSPB1POLBSMN1; SMN2NPC1RAB9A |
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 |