Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GALR3 | O60755 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.42 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5364904 | 0.78 | AR (0.62) | AR | |
| SCHEMBL6196775 | 0.76 | ESR2 (0.46) | TSHRAR | |
| SCHEMBL4921058 | 0.75 | ALDH1A1 (0.45) | CYP11B2KDM4EHPGDALDH1A1GALR3 | |
| SCHEMBL11560121 | 0.74 | CYP11B2 (0.49) | CYP11B2TRPV4SLC22A12CYP11B1AR | |
| SCHEMBL5358282 | 0.73 | CYP11B2 (0.41) | CYP11B2TRPV4CYP11B1ARMAOA | |
| SCHEMBL2320354 | 0.72 | AHR (0.41) | KDM4EHPGDGAAPDE3BPDE3A | |
| SCHEMBL5357681 | 0.72 | CASP1 (0.41) | CYP11B2KDM4EHPGDALDH1A1GALR3 | |
| SCHEMBL9205179 | 0.71 | CYP11B2 (0.52) | CYP11B2TRPV4SLC22A12CYP11B1AR | |
| SCHEMBL24186806 | 0.70 | CYP11B2 (0.44) | CYP11B2HPGDALDH1A1TRPV4CYP11B1 | |
| SCHEMBL6197205 | 0.70 | KCNH2 (0.44) | KDM4EALDH1A1PTGS1 |
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 |