Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.70 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.65 |
| ▸ | LMNA | P02545 | 3/20 | 0.65 |
| ▸ | HPGD | P15428 | 3/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | ALPG | P10696 | 1/20 | 0.65 |
| ▸ | LTA4H | P09960 | 1/20 | 0.61 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | CES2 | O00748 | 2/20 | 0.56 |
| ▸ | CES1 | P23141 | 2/20 | 0.56 |
| ▸ | RAB9A | P51151 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL27483853 | 1.00 | ALDH1A1 (0.70) | ALDH1A1SRD5A2LMNAHPGDSMN1; SMN2 | |
| Benzene SCHEMBL27709388 | 1.00 | ALDH1A1 (0.70) | ALDH1A1SRD5A2LMNAHPGDSMN1; SMN2 | |
| SCHEMBL251921 | 1.00 | ALDH1A1 (0.70) | ALDH1A1SRD5A2LMNAHPGDSMN1; SMN2 | |
| SCHEMBL17068941 | 1.00 | ALDH1A1 (0.70) | ALDH1A1SRD5A2LMNAHPGDSMN1; SMN2 | |
| SCHEMBL7373156 | 0.98 | ALDH1A1 (0.67) | ALDH1A1SRD5A2LMNAHPGDSMN1; SMN2 | |
| Fluorobenzene SCHEMBL28349300 | 0.93 | ALDH1A1 (0.61) | ALDH1A1SRD5A2LMNAHPGDSMN1; SMN2 | |
| SCHEMBL10513615 | 0.93 | LMNA (0.67) | ALDH1A1SRD5A2LMNAHPGDSMN1; SMN2 | |
| SCHEMBL7937415 | 0.93 | LMNA (0.67) | ALDH1A1SRD5A2LMNAHPGDSMN1; SMN2 | |
| SCHEMBL17950520 | 0.91 | ATM (0.75) | ALDH1A1SRD5A2LMNAHPGDSMN1; SMN2 | |
| SCHEMBL238259 | 0.89 | LTA4H (0.73) | ALDH1A1SRD5A2LMNAHPGDSMN1; SMN2 |
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 |