Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 2/20 | 0.61 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.56 |
| ▸ | BRD4 | O60885 | 5/20 | 0.53 |
| ▸ | BRD2 | P25440 | 5/20 | 0.53 |
| ▸ | BRD3 | Q15059 | 5/20 | 0.53 |
| ▸ | CCKBR | P32239 | 5/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.49 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.49 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.49 |
| ▸ | CCKAR | P32238 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9256442 | 1.00 | SCN9A (0.61) | SCN9ASENP1BRD4BRD2BRD3 | |
| SCHEMBL9256454 | 1.00 | SCN9A (0.61) | SCN9ASENP1BRD4BRD2BRD3 | |
| SCHEMBL4148160 | 0.88 | SCN9A (0.49) | SCN9ASENP1BRD4BRD2BRD3 | |
| SCHEMBL13904864 | 0.88 | SCN9A (0.49) | SCN9ASENP1BRD4BRD2BRD3 | |
| SCHEMBL6993452 | 0.87 | SCN9A (0.78) | SCN9ASENP1BRD4BRD2BRD3 | |
| SCHEMBL3788080 | 0.87 | SCN9A (0.78) | SCN9ASENP1BRD4BRD2BRD3 | |
| SCHEMBL7544783 | 0.86 | SCN9A (0.51) | SCN9ASENP1BRD4BRD2BRD3 | |
| SCHEMBL7544771 | 0.86 | SCN9A (0.51) | SCN9ASENP1BRD4BRD2BRD3 | |
| SCHEMBL6300291 | 0.86 | SCN9A (0.61) | SCN9ASENP1BRD4BRD2BRD3 | |
| SCHEMBL6301555 | 0.85 | SCN9A (0.57) | SCN9ASENP1BRD4BRD2BRD3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5451582-A | Cholecystokinins and gastrin receptor antagonists | MERCK SHARP & DOHME LTD. (GB) | 1995-09-19 | — | — | US | disclosed |
| WO-1993017011-A1 | BENZODIAZEPINE DERIVATIVES, AS CCK AND GASTRIN ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1993-09-02 | — | — | WO | disclosed |