Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.52 |
| ▸ | CTSK | P43235 | 7/20 | 0.50 |
| ▸ | ELANE | P08246 | 1/20 | 0.49 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.49 |
| ▸ | CTSS | P25774 | 4/20 | 0.48 |
| ▸ | CTSL | P07711 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | CTSB | P07858 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4316106 | 1.00 | ATM (0.52) | ATMCTSKELANECTRB1CTSS | |
| SCHEMBL3656918 | 1.00 | ATM (0.52) | ATMCTSKELANECTRB1CTSS | |
| Methylsulfanylmethane SCHEMBL6213966 | 0.94 | ATM (0.47) | ATMCTSKELANECTRB1CTSS | |
| SCHEMBL16473698 | 0.86 | ATM (0.54) | ATMCTSKELANECTRB1CTSS | |
| SCHEMBL14317559 | 0.86 | ATM (0.54) | ATMCTSKELANECTRB1CTSS | |
| SCHEMBL14247228 | 0.86 | ATM (0.54) | ATMCTSKELANECTRB1CTSS | |
| SCHEMBL24323665 | 0.84 | ALDH1A1 (0.58) | CTSKCTSSCTSLALDH1A1ALOX15 | |
| SCHEMBL24323651 | 0.84 | ALDH1A1 (0.58) | CTSKCTSSCTSLALDH1A1ALOX15 | |
| SCHEMBL1632289 | 0.84 | ATM (0.50) | ATMCTSKELANECTRB1CTSS | |
| SCHEMBL19548687 | 0.84 | TGM2 (0.53) | CTSKCTSLALDH1A1ALOX15 |
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-2195288-A2 | SMALL MOLECULE BRADYKININ B1 RECEPTOR ANTAGONISTS | Jerini AG (DE) | 2010-06-16 | — | — | EP | disclosed |
| WO-2009036996-A2 | SMALL MOLECULE BRADYKININ B1 RECEPTOR ANTAGONISTS | JERINI AG (DE) | 2009-03-26 | — | — | WO | disclosed |