Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.35 |
| ▸ | NOS1 | P29475 | 2/20 | 0.34 |
| ▸ | NOS2 | P35228 | 2/20 | 0.34 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
| ▸ | CCR2 | P41597 | 1/20 | 0.33 |
| ▸ | LSS | P48449 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10005570 | 0.94 | CYP1A2 (0.75) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL9407009 | 0.93 | CYP1A2 (0.58) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL9407012 | 0.93 | CYP1A2 (0.58) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL19478439 | 0.87 | CYP1A2 (0.64) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL8014247 | 0.86 | CYP1A2 (0.50) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL6748514 | 0.86 | CYP1A2 (0.50) | CYP1A2HTTLMNAMAPK1MAPT | |
| SCHEMBL1193058 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL6351644 | 0.84 | — | — | |
| SCHEMBL29186802 | 0.84 | — | — | |
| Octane SCHEMBL9146243 | 0.81 | CYP1A2 (0.76) | CYP1A2HTTLMNAMAPK1MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2727923-B1 | (METH) ALLYLSILANE COMPOUND, SILANE COUPLING AGENT THEREFOR, AND FUNCTIONAL MATERIAL USING SAME | SHIMADA TOYOSHI (JP) | 2017-10-18 | — | — | EP | disclosed |