Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XIAP | P98170 | 12/20 | 0.45 |
| ▸ | NPY1R | P25929 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | CCKBR | P32239 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7848691 | 0.87 | XIAP (0.46) | XIAPNPY1RCCKBR | |
| SCHEMBL7837557 | 0.84 | XIAP (0.40) | XIAPNPY1RCCKBR | |
| SCHEMBL7836155 | 0.78 | AADAT (0.52) | BCHEACHEHDAC6 | |
| Hydrochloric Acid SCHEMBL8476250 | 0.78 | AADAT (0.51) | BCHEACHEHDAC6 | |
| SCHEMBL5132571 | 0.74 | NPY1R (0.59) | XIAPNPY1RCCKBR | |
| SCHEMBL7416762 | 0.74 | NPY1R (0.59) | XIAPNPY1RCCKBR | |
| SCHEMBL7417336 | 0.74 | NPY1R (0.51) | XIAPNPY1RCCKBR | |
| SCHEMBL5651533 | 0.74 | NPY1R (0.52) | XIAPNPY1RHDAC6 | |
| SCHEMBL5132457 | 0.74 | NPY1R (0.52) | XIAPNPY1R | |
| SCHEMBL649566 | 0.74 | NPY1R (0.52) | XIAPNPY1RHDAC6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0802922-B1 | NOVEL AMINO ACID DERIVATIVES, METHOD OF PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM PHARMA (DE) | 2001-09-26 | — | — | EP | disclosed |
| US-5922878-A | NEUROKININ(TACHYKININ) ANTAGONIST FOR RESPIRATORY SYSTEM DISORDERSS FOR TREATMENT OF ASTHMA, SKIN DISORDERS OR ANTIINFLAMMATORY AGENTS | BOEHRINGER INGELHEIM GMBH (DE) | 1999-07-13 | — | — | US | disclosed |
| US-5712397-A | NEUROKININ ANTAGONISTS | BOEHRINGER INGELHEIM GMBH (DE) | 1998-01-27 | — | — | US | disclosed |
| EP-0802922-A1 | NOVEL AMINO ACID DERIVATIVES, METHOD OF PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1997-10-29 | — | — | EP | disclosed |
| WO-1995023810-A1 | NOVEL AMINO ACID DERIVATIVES, METHOD OF PRODUCING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM KG (DE) | 1995-09-08 | — | — | WO | disclosed |