Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 5/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | MME | P08473 | 3/20 | 0.34 |
| ▸ | ECE1 | P42892 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | VCP | P55072 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28722215 | 0.76 | GRM5 (0.44) | GRM5PTGDR2MMEECE1HCAR2 | |
| SCHEMBL6768178 | 0.71 | CA12 (0.40) | NPSR1GRM5MEN1KMT2AKDM4E | |
| SCHEMBL15841080 | 0.71 | GRM5 (0.41) | GRM5PTGDR2MMEECE1MEN1 | |
| SCHEMBL4174272 | 0.70 | MLYCD (0.44) | NPSR1MMEECE1KMT2AKDM4E | |
| SCHEMBL6773718 | 0.70 | PTGDR2 (0.43) | GRM5PTGDR2MMEECE1HCAR2 | |
| SCHEMBL30467436 | 0.70 | PTGDR2 (0.43) | GRM5PTGDR2MMEECE1HCAR2 | |
| SCHEMBL31182405 | 0.69 | GRM5 (0.44) | GRM5PTGDR2MMEECE1IKBKB | |
| SCHEMBL15062326 | 0.68 | NPSR1 (0.68) | NPSR1MEN1KMT2AKDM4ENPC1 | |
| SCHEMBL6774626 | 0.68 | GRM5 (0.46) | GRM5PTGDR2MMEECE1MEN1 | |
| SCHEMBL28499185 | 0.66 | GRM5 (0.38) | GRM5PTGDR2MMEECE1HCAR2 |
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-1326829-A2 | 17-BETA-HYDROXYSTEROID DEHYDROGENASE-II INHIBITORS | Bayer Pharmaceuticals Corporation (US) | 2003-07-16 | — | — | EP | disclosed |
| WO-2002026706-A2 | 17-BETA-HYDROXYSTEROID DEHYDROGENASE-II INHIBITORS | BAYER PHARMACEUTICALS CORPORATION (US) | 2002-04-04 | — | — | WO | disclosed |