Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PTGES | O14684 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | EDNRB | P24530 | 1/20 | 0.40 |
| ▸ | EDNRA | P25101 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9401416 | 0.80 | CYP1A2 (0.42) | KMT2AADORA3 | |
| SCHEMBL9562993 | 0.79 | CYP1A2 (0.41) | KMT2AADORA3 | |
| SCHEMBL9562994 | 0.78 | CYP1A2 (0.41) | EDNRBEDNRAADORA3 | |
| SCHEMBL9706660 | 0.77 | MAPT (0.42) | KMT2APTGESALOX5MAPTEDNRB | |
| SCHEMBL9562977 | 0.75 | ADORA3 (0.45) | MAPTADORA3 | |
| SCHEMBL7937196 | 0.74 | EDNRB (0.49) | EDNRBEDNRA | |
| SCHEMBL1069539 | 0.73 | EDNRB (0.55) | EDNRBEDNRA | |
| SCHEMBL8871840 | 0.73 | KMT2A (0.49) | KMT2ATP53GLAMAPTEDNRB | |
| SCHEMBL13851483 | 0.73 | ALOX5 (0.44) | PTGESALOX5 | |
| SCHEMBL13851482 | 0.73 | ALOX5 (0.44) | PTGESALOX5 |
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-6235903-B1 | Method for preparing sulfanyl-type endothelin receptor antagonists | BASF AKTIENGESELLSCHAFT (DE) | 2001-05-22 | — | — | US | disclosed |