Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 18/20 | 1.00 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TTR | P02766 | 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 | |
|---|---|---|---|---|
| SCHEMBL23560207 | 0.84 | AHR (0.72) | AHRSMN1; SMN2TTR | |
| SCHEMBL24296146 | 0.82 | AHR (0.70) | AHRSMN1; SMN2TTR | |
| SCHEMBL23690156 | 0.81 | AHR (0.68) | AHRSMN1; SMN2TTR | |
| SCHEMBL24589131 | 0.79 | AHR (0.66) | AHRSMN1; SMN2TTR | |
| SCHEMBL24155724 | 0.79 | AHR (0.66) | AHRSMN1; SMN2TTR | |
| SCHEMBL2278973 | 0.79 | AHR (1.00) | AHR | |
| SCHEMBL29568936 | 0.79 | AHR (1.00) | AHR | |
| SCHEMBL24589016 | 0.78 | AHR (0.64) | AHRSMN1; SMN2 | |
| SCHEMBL29349569 | 0.78 | AHR (1.00) | AHR | |
| SCHEMBL2281485 | 0.78 | AHR (1.00) | AHR |
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-7996156-B2 | Methods for predicting properties of molecules | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2011-08-09 | — | — | US | disclosed |
| EP-0086745-A1 | Process for the preparation of a very pure commercial form of 4,2',4'-trichloro-2-hydroxydiphenyl ether | CIBA-GEIGY AG (CH) | 1983-08-24 | — | — | EP | disclosed |