Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.53 |
| ▸ | CTSB | P07858 | 2/20 | 0.44 |
| ▸ | CTSS | P25774 | 2/20 | 0.44 |
| ▸ | CTSV | O60911 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NCEH1 | Q6PIU2 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.41 |
| ▸ | MMP3 | P08254 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9536835 | 0.82 | PLK1 (0.60) | EGLN1CTSBCTSSCTSVCTSL | |
| SCHEMBL2322433 | 0.79 | NCEH1 (0.60) | EGLN1SMN1; SMN2NCEH1KMT2AALDH1A1 | |
| SCHEMBL15505756 | 0.79 | PLK1 (0.64) | MAPTSMN1; SMN2NPC1RAB9ANCEH1 | |
| SCHEMBL31047578 | 0.77 | NCEH1 (0.57) | SMN1; SMN2NCEH1KDM4EALDH1A1GAA | |
| SCHEMBL27713015 | 0.77 | SMN1; SMN2 (0.44) | MAPTSMN1; SMN2NPC1RAB9ANCEH1 | |
| SCHEMBL31047597 | 0.77 | NCEH1 (0.57) | SMN1; SMN2NCEH1KDM4EALDH1A1GAA | |
| SCHEMBL2332306 | 0.75 | EGLN1 (0.60) | EGLN1MAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL6844201 | 0.75 | KDM4E (0.48) | MAPTSMN1; SMN2NPC1RAB9ANCEH1 | |
| SCHEMBL7413948 | 0.73 | NCEH1 (0.43) | CTSBCTSSCTSVCTSLMAPT | |
| SCHEMBL31520424 | 0.73 | POLB (0.52) | MAPTSMN1; SMN2NPC1RAB9ANCEH1 |
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-1157003-A1 | ACYLATED AMINOACETONITRILES AS CYSTEINE PROTEASE INHIBITORS | AstraZeneca AB (SE) | 2001-11-28 | — | — | EP | disclosed |
| WO-2000048992-A1 | ACYLATED AMINOACETONITRILES AS CYSTEINE PROTEASE INHIBITORS | ASTRAZENECA AB (SE) | 2000-08-24 | — | — | WO | disclosed |