Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.38 |
| ▸ | CHRNG | P07510 | 1/20 | 0.38 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | CHRND | Q07001 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29941731 | 0.80 | CYP1A2 (0.51) | ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL109994 | 0.74 | CYP1A2 (0.50) | CYP1A2 | |
| SCHEMBL9017957 | 0.74 | NPC1 (0.41) | ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL7388625 | 0.72 | ITGB1 (0.44) | CYP3A4HSD11B1HDAC6 | |
| SCHEMBL25281081 | 0.69 | SLC6A3 (0.42) | SLC6A3SLC6A2HSD11B1SLC6A4MAOA | |
| SCHEMBL21575093 | 0.69 | HDAC6 (0.47) | SLC6A3SLC6A2CYP1A2CYP3A4HSD11B1 | |
| SCHEMBL21574977 | 0.69 | ACHE (0.45) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL21575094 | 0.69 | HDAC6 (0.44) | SLC6A3SLC6A2ALDH1A1HSD11B1HDAC6 | |
| SCHEMBL18306930 | 0.69 | OPRM1 (0.50) | SLC6A3SLC6A2HSD11B1POLBSLC6A4 | |
| SCHEMBL6154699 | 0.69 | OPRM1 (0.50) | SLC6A3SLC6A2HSD11B1POLBSLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6201016-B1 | IMMUNOSUPPRESSANT AS 5-LIPOXYGENASE INHIBITOR AND/OR AS PLATELET ACTIVATING FACTOR RECEPTOR ANTAGONIST | CYTOMED INCORPORATED | 2001-03-13 | — | — | US | disclosed |