Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.38 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | TET3 | O43151 | 2/20 | 0.38 |
| ▸ | FBXL19 | Q6PCT2 | 2/20 | 0.38 |
| ▸ | CXXC5 | Q7LFL8 | 2/20 | 0.38 |
| ▸ | KDM2B | Q8NHM5 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL351393 | 0.87 | AKR1C1 (0.55) | CYP2C19AKR1C1CYP1A2KMT2AMEN1 | |
| SCHEMBL3485961 | 0.83 | AKR1C1 (0.62) | CYP2C19AKR1C1CYP1A2KMT2AMEN1 | |
| SCHEMBL1048151 | 0.83 | AKR1C1 (0.68) | CYP2C19AKR1C1CYP1A2KMT2AMEN1 | |
| SCHEMBL631791 | 0.83 | AKR1C1 (0.68) | CYP2C19AKR1C1KMT2AMEN1CYP2C9 | |
| SCHEMBL5768239 | 0.82 | CYP2C9 (0.50) | CYP2C19AKR1C1KMT2AMEN1TSHR | |
| SCHEMBL11097640 | 0.82 | AKR1C1 (0.47) | CYP2C19AKR1C1KMT2AMEN1TSHR | |
| SCHEMBL11075416 | 0.82 | KMT2A (0.54) | AKR1C1KMT2AMEN1CYP2C9HSD11B1 | |
| SCHEMBL2860893 | 0.81 | AKR1C1 (0.66) | CYP2C19AKR1C1CYP1A2KMT2AMEN1 | |
| SCHEMBL3821416 | 0.81 | AKR1C1 (0.66) | CYP2C19AKR1C1CYP1A2KMT2AMEN1 | |
| SCHEMBL15912397 | 0.81 | CYP2C19 (0.50) | CYP2C19AKR1C1CYP1A2KMT2AMEN1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105899507-B | Aryl sultam derivative as RORc regulator | 豪夫迈·罗氏有限公司 | 2019-06-07 | — | — | CN | disclosed |
| CN-105899507-A | Aryl sultam derivatives as rorc modulators | 豪夫迈·罗氏有限公司 | 2016-08-24 | — | — | CN | disclosed |
| US-4460604-A | ANALGESICS, NARCOTIC ANTAGONIST | THE UPJOHN COMPANY (US) | 1984-07-17 | — | — | US | disclosed |
| US-4180584-A | ANALGESIC; NARCOTIC ANTAGONIST | THE UPJOHN COMPANY (US) | 1979-12-25 | — | — | US | disclosed |
| US-4065573-A | ANALGESICS | THE UPJOHN COMPANY (US) | 1977-12-27 | — | — | US | disclosed |