Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 3/20 | 0.57 |
| ▸ | CTSK | P43235 | 3/20 | 0.57 |
| ▸ | CTSS | P25774 | 2/20 | 0.57 |
| ▸ | CTSL | P07711 | 2/20 | 0.57 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CASP1 | P29466 | 2/20 | 0.50 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1058883 | 1.00 | CTSB (0.57) | CTSBCTSKCTSSCTSLCTRB1 | |
| SCHEMBL5656036 | 0.88 | CASP1 (0.55) | CTSBCTSKCTSSCTSLCTRB1 | |
| SCHEMBL10254007 | 0.86 | CYP1A2 (0.48) | CTSBCTSKCTSSCTSLCTRB1 | |
| SCHEMBL18576284 | 0.85 | CTSB (0.52) | CTSBCTSKCTSSCTSLCTRB1 | |
| SCHEMBL8759866 | 0.84 | CTSB (0.54) | CTSBCTSKCTSSCTSLALDH1A1 | |
| SCHEMBL18576842 | 0.84 | CTSK (0.54) | CTSBCTSKCTSSCTSLCTRB1 | |
| SCHEMBL22225460 | 0.84 | CTSK (0.61) | CTSBCTSKCTSSCTSLALDH1A1 | |
| SCHEMBL28546631 | 0.84 | CTSK (0.67) | CTSBCTSKCTSSCTSLALDH1A1 | |
| SCHEMBL4622697 | 0.84 | CTSK (0.67) | CTSBCTSKCTSSCTSLALDH1A1 | |
| SCHEMBL4800376 | 0.84 | CTSK (0.67) | CTSBCTSKCTSSCTSLALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017032487-A1 | PROTEASOME INHIBITOR COMPRISING A SIGNAL-EMITTING MOIETY | Technische Universität München (DE) | 2017-03-02 | — | — | WO | disclosed |
| WO-2017032487-A1 | PROTEASOME INHIBITOR COMPRISING A SIGNAL-EMITTING MOIETY | Technische Universität München (DE) | 2017-03-02 | — | — | WO | disclosed |
| US-5322963-A | Reacting alpha-amino aldehyde derivative with silanol derivative in presence of boron trifluoride-ether complex or tin tetrachloride catalyst | JAPAN TOBACCO, INC. (JP) | 1994-06-21 | — | — | US | disclosed |
| EP-0523248-A1 | PROCESS FOR PRODUCING $g(a)-AMINO-$g(b),$g(d)-DIOL DERIVATIVE | Japan Tobacco Inc. (JP) | 1993-01-20 | — | — | EP | disclosed |