Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.38 |
| ▸ | MEN1 | O00255 | 6/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1670787 | 0.82 | MAPKAPK2 (0.47) | MAPKAPK2GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL28350054 | 0.76 | GRM2 (0.47) | MAPKAPK2GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL12800377 | 0.76 | MAPT (0.44) | MAPKAPK2ALDH1A1MAPTKMT2AMEN1 | |
| SCHEMBL1671716 | 0.71 | GRIA2 (0.41) | ALDH1A1MAPTKDM4ENPSR1RXFP1 | |
| SCHEMBL7574828 | 0.68 | KMT2A (0.55) | GRM2ALDH1A1MAPTKDM4ENPSR1 | |
| SCHEMBL1670712 | 0.67 | PGR (0.44) | ALDH1A1MAPTKDM4EHPGDKMT2A | |
| SCHEMBL1185054 | 0.67 | ALDH1A1 (0.47) | MAPKAPK2ALDH1A1MAPTKDM4ENPSR1 | |
| SCHEMBL12800389 | 0.66 | MAPT (0.44) | MAPKAPK2ALDH1A1MAPTKMT2AMEN1 | |
| SCHEMBL29663328 | 0.66 | PGR (0.50) | GABRA1GABRG2GABRB3GABRA3GABRA2 | |
| SCHEMBL12670739 | 0.65 | PRKAB2 (0.51) | GABRA1GABRG2GABRB3GABRA3GABRA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011042477-A1 | SUBSTITUTED PYRROLES AND IMIDAZOLES AS ESTROGEN RECEPTOR LIGANDS | KARO BIO AB (SE) | 2011-04-14 | — | — | WO | disclosed |