Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKAR | P32238 | 4/20 | 0.61 |
| ▸ | CCKBR | P32239 | 4/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7468864 | 0.88 | ALDH1A1 (0.58) | CCKARCCKBRALDH1A1MEN1KMT2A | |
| SCHEMBL6180507 | 0.81 | CCKAR (0.51) | CCKARCCKBRALDH1A1MEN1KMT2A | |
| SCHEMBL8946837 | 0.77 | CCKBR (0.62) | CCKARCCKBRALDH1A1MEN1KMT2A | |
| SCHEMBL14520869 | 0.77 | CCKBR (1.00) | CCKARCCKBR | |
| SCHEMBL8946676 | 0.77 | CCKBR (1.00) | CCKARCCKBR | |
| SCHEMBL8946830 | 0.75 | CCKBR (0.74) | CCKARCCKBR | |
| SCHEMBL7088452 | 0.73 | CHRM2 (0.58) | CCKBRALDH1A1MEN1KMT2ACHRM2 | |
| SCHEMBL8865990 | 0.73 | CCKBR (0.63) | CCKBR | |
| SCHEMBL4075043 | 0.72 | CHRM2 (0.56) | CCKBRALDH1A1MEN1KMT2APOLB | |
| SCHEMBL8691247 | 0.72 | HTT (0.38) | CCKARALDH1A1POLBMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5585376-A | 1,5-benzodiazepine derivatives having CCK and/or gastrin antagonistic activity | GLAXO WELLCOME INC. (US) | 1996-12-17 | — | — | US | disclosed |