Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 7/20 | 0.48 |
| ▸ | CTSS | P25774 | 5/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.48 |
| ▸ | CTSL | P07711 | 7/20 | 0.45 |
| ▸ | CTSB | P07858 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KDM4A | O75164 | 1/20 | 0.41 |
| ▸ | GUSB | P08236 | 1/20 | 0.40 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6443745 | 0.93 | CTSS (0.47) | NPC1RAB9ASMN1; SMN2CTSKCTSS | |
| SCHEMBL6442019 | 0.90 | CTSS (0.42) | NPC1RAB9ASMN1; SMN2CTSKCTSS | |
| SCHEMBL5517758 | 0.88 | CTSK (0.61) | NPC1RAB9ASMN1; SMN2CTSKCTSS | |
| SCHEMBL6445311 | 0.88 | ALDH1A1 (0.47) | SMN1; SMN2CTSKCTSSEPHX2CTSL | |
| SCHEMBL6447322 | 0.87 | CTSK (0.42) | NPC1RAB9ASMN1; SMN2CTSKCTSS | |
| SCHEMBL6446599 | 0.87 | GUSB (0.43) | NPC1RAB9ASMN1; SMN2CTSKCTSS | |
| SCHEMBL6448077 | 0.86 | KDM4E (0.54) | NPC1RAB9ACTSKCTSSCTSL | |
| SCHEMBL6444047 | 0.86 | CTSL (0.53) | NPC1SMN1; SMN2CTSLPOLBGPR139 | |
| SCHEMBL6443471 | 0.84 | RAB9A (0.46) | NPC1RAB9ASMN1; SMN2CTSKCTSS | |
| SCHEMBL6445366 | 0.83 | CTSS (0.47) | CTSKCTSSCTSLCTSBPOLB |
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-1575903-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | Jerini AG (DE) | 2005-09-21 | — | — | EP | disclosed |
| WO-2004065353-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | JERINI AG (DE) | 2004-08-05 | — | — | WO | disclosed |