Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | CTSB | P07858 | 4/20 | 0.52 |
| ▸ | CTSL | P07711 | 4/20 | 0.52 |
| ▸ | CTSS | P25774 | 3/20 | 0.52 |
| ▸ | CTSK | P43235 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | CTSG | P08311 | 1/20 | 0.45 |
| ▸ | CMA1 | P23946 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4268532 | 0.81 | SMN1; SMN2 (0.63) | SMN1; SMN2HPGDLMNAPKMCTSG | |
| SCHEMBL21759695 | 0.81 | SMN1; SMN2 (0.63) | SMN1; SMN2HPGDLMNAPKMCTSG | |
| SCHEMBL6183685 | 0.81 | CTSL (0.63) | SMN1; SMN2CTSBCTSLCTSSCTSK | |
| SCHEMBL20877889 | 0.79 | SMN1; SMN2 (0.60) | SMN1; SMN2HPGDLMNAPKMCTSG | |
| SCHEMBL26259892 | 0.79 | SMN1; SMN2 (0.60) | SMN1; SMN2HPGDLMNAPKMCTSG | |
| SCHEMBL22392193 | 0.78 | SMN1; SMN2 (0.59) | SMN1; SMN2HPGDLMNAPKMCTSG | |
| SCHEMBL6183072 | 0.78 | CTSK (0.80) | CTSBCTSLCTSSCTSK | |
| SCHEMBL26709736 | 0.77 | SMN1; SMN2 (0.54) | SMN1; SMN2CTSBCTSLCTSSCTSK | |
| SCHEMBL9595087 | 0.76 | SMN1; SMN2 (0.60) | SMN1; SMN2HPGDLMNAPKMCTSG | |
| SCHEMBL6019894 | 0.76 | CTSL (0.51) | CTSBCTSLCTSSCTSK |
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 |
|---|---|---|---|---|---|---|---|
| EP-1161415-A2 | N-CYANOMETHYLAMIDES AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2001-12-12 | — | — | EP | disclosed |
| WO-2000055126-A2 | N-CYANOMETHYLAMIDES AS PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2000-09-21 | — | — | WO | disclosed |