Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CTSD | P07339 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 7/20 | 0.36 |
| ▸ | HTR2B | P41595 | 6/20 | 0.36 |
| ▸ | HTR2A | P28223 | 4/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5481415 | 0.84 | NPSR1 (0.45) | NPSR1ALDH1A1LMNACTSDHTR2C | |
| SCHEMBL6985693 | 0.81 | ITGB1 (0.49) | NPSR1ALDH1A1LMNACTSDHTR2C | |
| SCHEMBL27972516 | 0.79 | CTSD (0.48) | NPSR1ALDH1A1LMNACTSD | |
| SCHEMBL5476708 | 0.79 | NPSR1 (0.46) | NPSR1ALDH1A1LMNA | |
| SCHEMBL10642101 | 0.78 | NPSR1 (0.40) | NPSR1ALDH1A1LMNAMAPTHPGD | |
| SCHEMBL10642654 | 0.77 | SMN1; SMN2 (0.47) | NPSR1ALDH1A1MAPT | |
| SCHEMBL10638158 | 0.77 | NPSR1 (0.42) | NPSR1ALDH1A1LMNAMAOB | |
| SCHEMBL10642483 | 0.76 | GPBAR1 (0.42) | NPSR1ALDH1A1LMNACREBBPHTR2C | |
| SCHEMBL27972717 | 0.73 | KDM1A (0.43) | NPSR1ALDH1A1LMNAKDM4EMAPT | |
| SCHEMBL10637116 | 0.72 | FPR1 (0.41) | HTR2CHTR2BHTR2A |
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 |