Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 7/20 | 0.37 |
| ▸ | MT-CO2 | P00403 | 2/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | XIAP | P98170 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | CCKAR | P32238 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 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 | |
|---|---|---|---|---|
| SCHEMBL8808190 | 0.85 | MAPT (0.43) | CCKBRMT-CO2ALOX5RAB9ACYP1A2 | |
| SCHEMBL8808182 | 0.84 | CCKBR (0.35) | CCKBRMT-CO2ALOX5RAB9ACYP1A2 | |
| SCHEMBL8519231 | 0.81 | GAA (0.37) | CCKBRRAB9AMAPTCCKARALDH1A1 | |
| SCHEMBL8405648 | 0.78 | ALDH1A1 (0.33) | CCKBRRAB9AMAPTKMT2ACCKAR | |
| SCHEMBL8406820 | 0.77 | KMT2A (0.39) | RAB9ACYP1A2MAPTKMT2AALDH1A1 | |
| SCHEMBL7597322 | 0.76 | CCKBR (0.58) | CCKBRCCKAR | |
| SCHEMBL8816285 | 0.75 | CCKAR (0.41) | CCKBRRAB9ACYP1A2MAPTKMT2A | |
| SCHEMBL8805217 | 0.75 | CCKAR (0.41) | CCKBRCYP1A2XIAPMAPTKMT2A | |
| SCHEMBL6906918 | 0.75 | AADAT (0.36) | CYP1A2CYP2D6MAPTKMT2AALDH1A1 | |
| SCHEMBL8805216 | 0.75 | ALDH1A1 (0.35) | CCKBRCYP1A2MAPTKMT2ACCKAR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0694039-B1 | 1,5-BENZODIAZEPINE DERIVATIVES HAVING CCK ANTAGONISTIC AND OR AGONISTIC ACTIVITY | GLAXO WELLCOME INC (US) | 2001-01-24 | — | — | EP | disclosed |
| US-5646140-A | CHOLECYSTOKININ ANTAGONIST; APETITE CONTROL | GLAXO WELLCOME INC. (US) | 1997-07-08 | — | — | US | disclosed |
| WO-1994024149-A1 | 1,5-BENZODIAZEPINE DERIVATIVES HAVING CCK ANTAGONISTIC OR AGONISTIC ACTIVITY | GLAXO INC. (US) | 1994-10-27 | — | — | WO | disclosed |