Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.32 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6160469 | 1.00 | CCKBR (0.43) | CCKBREPHX2CYP17A1CYP19A1CYP1A2 | |
| SCHEMBL6158115 | 1.00 | CCKBR (0.43) | CCKBREPHX2CYP17A1CYP19A1CYP1A2 | |
| SCHEMBL6160216 | 1.00 | CCKBR (0.43) | CCKBREPHX2CYP17A1CYP19A1CYP1A2 | |
| SCHEMBL6159387 | 1.00 | CCKBR (0.43) | CCKBREPHX2CYP17A1CYP19A1CYP1A2 | |
| SCHEMBL6160311 | 0.88 | EPHX2 (0.38) | EPHX2 | |
| SCHEMBL6161680 | 0.86 | CCKBR (0.60) | CCKBR | |
| SCHEMBL6161619 | 0.86 | CCKBR (0.60) | CCKBR | |
| SCHEMBL6160599 | 0.86 | CCKBR (0.47) | CCKBREPHX2CYP19A1ALDH1A1KMT2A | |
| SCHEMBL6160058 | 0.86 | CCKBR (0.47) | CCKBREPHX2CYP19A1ALDH1A1KMT2A | |
| SCHEMBL6160565 | 0.86 | CCKBR (0.47) | CCKBREPHX2CYP19A1ALDH1A1KMT2A |
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-1178969-B1 | GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS | BLACK JAMES FOUNDATION (GB) | 2005-07-13 | — | — | EP | disclosed |
| US-6479531-B1 | Gastrin and cholecystokinin receptor ligands | JAMES BLACK FOUNDATION LIMITED (GB) | 2002-11-12 | — | — | US | disclosed |