Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.42 |
| ▸ | PNMT | P11086 | 3/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.42 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | CMA1 | P23946 | 1/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | TDP2 | O95551 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TGM2 | P21980 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14550603 | 1.00 | BRD4 (0.51) | BRD4ADRA2APNMTADRA2BADRA2C | |
| SCHEMBL1347544 | 0.84 | BRD4 (0.49) | BRD4ADRA2APNMTADRA2BADRA2C | |
| SCHEMBL434007 | 0.81 | ACHE (0.49) | BRD4POLBPKMPDE3BPDE3A | |
| SCHEMBL18743294 | 0.81 | ACHE (0.49) | BRD4POLBPKMPDE3BPDE3A | |
| SCHEMBL14721601 | 0.80 | CA9 (0.40) | BRD4MAPTLMNAPDE3BPDE3A | |
| SCHEMBL4596331 | 0.80 | BRD4 (0.47) | BRD4ADRA2APNMTADRA2BADRA2C | |
| SCHEMBL7866698 | 0.80 | AHR (0.53) | ADRA2AADRA2BADRA2CCMA1AHR | |
| SCHEMBL5131215 | 0.80 | BRD4 (0.47) | BRD4ADRA2APNMTADRA2BADRA2C | |
| SCHEMBL31398247 | 0.80 | BRD4 (0.44) | BRD4ADRA2APNMTADRA2BADRA2C | |
| Hydrochloric Acid SCHEMBL25330756 | 0.79 | BRD4 (0.46) | BRD4ADRA2APNMTADRA2BADRA2C |
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-0815103-A1 | TRYPSIN AND THROMBIN INHIBITORS | Novartis AG (CH) | 1998-01-07 | — | — | EP | disclosed |
| WO-1996029327-A1 | TRYPSIN AND THROMBIN INHIBITORS | NOVARTIS AG (CH) | 1996-09-26 | — | — | WO | disclosed |