Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.33 |
| ▸ | MEN1 | O00255 | 6/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL9683424 | 0.85 | CCKBR (0.38) | CCKBRL3MBTL1KMT2AMEN1CYP1A2 | |
| SCHEMBL9499330 | 0.81 | CCKBR (0.58) | CCKBRHDAC1HDAC8HDAC6KMT2A | |
| SCHEMBL9499432 | 0.74 | OPRM1 (0.49) | CCKBR | |
| SCHEMBL9500460 | 0.69 | OPRD1 (0.60) | CCKBR | |
| SCHEMBL9501463 | 0.69 | LMNA (0.52) | CCKBRKMT2AALDH1A1GAAHTT | |
| SCHEMBL9501442 | 0.68 | CCKBR (0.62) | CCKBRKMT2AMEN1KDM4EALDH1A1 | |
| SCHEMBL9501031 | 0.67 | CCKBR (0.64) | CCKBRHTR2ASMN1; SMN2 | |
| SCHEMBL3650807 | 0.62 | KMT2A (0.51) | CXCR4KMT2AMEN1KDM4EALDH1A1 | |
| SCHEMBL11683129 | 0.60 | HTR2C (0.46) | KMT2AMEN1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3652732 | 0.59 | KMT2A (0.51) | CXCR4KMT2AMEN1HTR2CHRH3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0486271-A2 | Cholecystokinin antagonists for treating neurological disorders | MERCK & CO. INC. (US) | 1992-05-20 | — | — | EP | claimed |