Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 2/20 | 0.38 |
| ▸ | AR | P10275 | 5/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CCNC | P24863 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | PIK3R1 | P27986 | 2/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.33 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.33 |
| ▸ | KLK1 | P06870 | 1/20 | 0.33 |
| ▸ | KDM5A | P29375 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MARK3 | P27448 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5354656 | 0.84 | AR (0.40) | CYP11B2ARLMNAMAPTKDM4E | |
| SCHEMBL5358762 | 0.84 | CYP11B2 (0.40) | CYP11B2ARLMNAMAPTKDM4E | |
| SCHEMBL5357164 | 0.80 | CYP11B2 (0.39) | CYP11B2ARLMNAMAPTKDM4E | |
| SCHEMBL14347747 | 0.79 | MAPT (0.39) | CYP11B2ARLMNAMAPTKDM4E | |
| SCHEMBL5365592 | 0.78 | CYP11B2 (0.41) | CYP11B2ARLMNAMAPTKDM4E | |
| SCHEMBL5377673 | 0.76 | AR (0.48) | ARLMNAKDM5AALDH1A1 | |
| SCHEMBL6889076 | 0.74 | AR (0.51) | CYP11B2ARLMNAMAPTKDM4E | |
| SCHEMBL5365214 | 0.73 | CYP11B2 (0.43) | CYP11B2ARLMNAMAPTKDM4E | |
| SCHEMBL5362436 | 0.73 | CYP11B2 (0.40) | CYP11B2ARLMNAMAPTKDM4E | |
| SCHEMBL5362630 | 0.72 | AR (0.41) | CYP11B2ARLMNAMAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007145349-A2 | SUBSTITUTED PYRROLE DERIVATIVES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-12-21 | — | — | WO | disclosed |
| WO-2007145349-A2 | SUBSTITUTED PYRROLE DERIVATIVES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-12-21 | — | — | WO | disclosed |