Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 12/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 12/20 | 0.41 |
| ▸ | NOD1 | Q9Y239 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL865793 | 0.84 | FOLH1 (0.35) | ITGB3ITGA2BCTSSCTSK | |
| SCHEMBL865794 | 0.84 | FOLH1 (0.35) | ITGB3ITGA2BCTSSCTSK | |
| SCHEMBL191310 | 0.81 | CTSK (0.43) | ITGB3ITGA2BCTSSCTSK | |
| SCHEMBL490696 | 0.81 | CTSK (0.43) | ITGB3ITGA2BCTSSCTSK | |
| SCHEMBL191311 | 0.81 | CTSK (0.43) | ITGB3ITGA2BCTSSCTSK | |
| SCHEMBL7112411 | 0.81 | ITGB3 (0.36) | ITGB3ITGA2BRAB9A | |
| SCHEMBL283288 | 0.80 | ITGB3 (0.46) | ITGB3ITGA2BNOD1CTSK | |
| SCHEMBL1077922 | 0.80 | NOD1 (0.48) | ITGB3ITGA2BNOD1CTSSCTSK | |
| SCHEMBL7382637 | 0.80 | NOD1 (0.48) | ITGB3ITGA2BNOD1CTSSCTSK | |
| SCHEMBL3655323 | 0.80 | ITGB3 (0.46) | ITGB3ITGA2BNOD1CTSK |
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-2513066-A1 | SPHINGOSINE KINASE INHIBITORS | Merck Patent GmbH (DE) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011082732-A1 | SPHINGOSINE KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2011-07-14 | — | — | WO | disclosed |