Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.46 |
| ▸ | CES1 | P23141 | 5/20 | 0.42 |
| ▸ | CES2 | O00748 | 4/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3039305 | 0.88 | AKR1C1 (0.53) | AKR1C1CES1CES2AKR1C2CA12 | |
| SCHEMBL3039302 | 0.88 | AKR1C1 (0.53) | AKR1C1CES1CES2AKR1C2CA12 | |
| SCHEMBL348321 | 0.88 | AKR1C1 (0.53) | AKR1C1CES1CES2AKR1C2CA12 | |
| SCHEMBL6971325 | 0.82 | CES1 (0.44) | AKR1C1CES1CES2CA12CA1 | |
| SCHEMBL4755644 | 0.82 | CES2 (0.59) | AKR1C1CES1CES2CA12CA1 | |
| SCHEMBL14764079 | 0.82 | CES1 (0.48) | AKR1C1CES1CES2CA12CA1 | |
| SCHEMBL1028536 | 0.81 | MAPT (0.45) | AKR1C1CES1CES2CA12CA1 | |
| SCHEMBL16246414 | 0.81 | MAPT (0.45) | AKR1C1CES1CES2CA12CA1 | |
| SCHEMBL29117706 | 0.77 | ALDH1A1 (0.54) | LMNAMAPTKMT2AKDM4EMEN1 | |
| SCHEMBL27395930 | 0.77 | ALDH1A1 (0.40) | AKR1C1CES1CES2CA12CA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1038877-B1 | Binaphthol monophosphoric acid derivative and its use | TOSOH CORP (JP) | 2004-03-10 | — | — | EP | disclosed |
| US-6274745-B1 | CATALYST | TOSOH CORPORATION (JP) | 2001-08-14 | — | — | US | disclosed |
| EP-1038877-A1 | Binaphthol monophosphoric acid derivative and its use | Tosoh Corporation (JP) | 2000-09-27 | — | — | EP | disclosed |