Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 7/20 | 0.46 |
| ▸ | AADAT | Q8N5Z0 | 2/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8402244 | 0.89 | CCKBR (0.46) | CCKBRAADATKDM4CRAB9ACYP2C19 | |
| SCHEMBL8913293 | 0.82 | CCKBR (0.46) | CCKBRAADATRAB9A | |
| SCHEMBL8398546 | 0.80 | CCKBR (0.48) | CCKBR | |
| SCHEMBL8398527 | 0.79 | CCKBR (0.48) | CCKBRAADATKDM4CRAB9ATSHR | |
| SCHEMBL8398551 | 0.79 | CYP2C19 (0.41) | CCKBRAADATCYP2C19TSHRLMNA | |
| SCHEMBL8402444 | 0.78 | CCKBR (0.49) | CCKBRCYP2C19MEN1KMT2AALDH1A1 | |
| SCHEMBL8403258 | 0.78 | CCKBR (0.44) | CCKBRAADATKDM4CRAB9ATSHR | |
| SCHEMBL9544058 | 0.73 | CCKBR (0.47) | CCKBRAADATCYP2C19MEN1KMT2A | |
| SCHEMBL8398983 | 0.73 | CCKBR (0.37) | CCKBRKDM4CMAPK1RECQL | |
| SCHEMBL8912603 | 0.73 | CCKBR (0.46) | CCKBRRAB9A |
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-0711283-B1 | TETRAHYDRO-1H-BENZAZEPINONES AND HEXAHYDROAZEPINONES AS SELECTIVE CHOLECYSTOKININ-B RECEPTOR ANTAGONISTS | PFIZER (US) | 1999-06-16 | — | — | EP | disclosed |
| US-5618811-A | Tetrahydro-1H-benzazepinones and hexahydroazepinones as selective cholecystokinin-B receptor antagonists | PFIZER INC. (US) | 1997-04-08 | — | — | US | disclosed |