Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 6/20 | 0.43 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.36 |
| ▸ | CD38 | P28907 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | GRK2 | P25098 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 2/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| SCHEMBL6565363 | 0.78 | GAA (0.41) | LRRK2ALDH1A1L3MBTL1 | |
| SCHEMBL6562060 | 0.76 | PLA2G7 (0.39) | LRRK2ALDH1A1GRM5NOS3NOS1 | |
| SCHEMBL6563213 | 0.75 | KMT2A (0.39) | LRRK2CYP11B1CYP11B2GRM5 | |
| SCHEMBL7808322 | 0.75 | NPC1 (0.39) | LRRK2GRK2GRM5NOS3NOS1 | |
| SCHEMBL6563806 | 0.74 | ACACB (0.52) | ACACB | |
| SCHEMBL4810734 | 0.72 | CYP19A1 (0.68) | CYP19A1CD38ALDH1A1CYP11B1CYP11B2 | |
| SCHEMBL17039626 | 0.71 | CYP19A1 (0.52) | CYP19A1CD38ALDH1A1CACNA1BCYP11B1 | |
| SCHEMBL5885749 | 0.71 | ACACB (0.48) | ALDH1A1ACACB | |
| SCHEMBL5885707 | 0.71 | ACACB (0.38) | ALDH1A1ACACBGRM5 | |
| SCHEMBL18184936 | 0.70 | CYP19A1 (0.56) | CYP19A1CD38ALDH1A1CYP11B1CYP11B2 |
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-1140802-B1 | SUBSTITUTED ARYL AND HETEROARYL DERIVATIVES, THEIR PRODUCTION AND THEIR USE AS MEDICINES | BOEHRINGER INGELHEIM PHARMA (DE) | 2004-03-17 | — | — | EP | disclosed |
| US-6479524-B1 | TO PROLONG THE THROMBIN TIME | BOEHRINGER INGELHEIM PHARMA KG (DE) | 2002-11-12 | — | — | US | disclosed |