Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | CASR | P41180 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | IGF1R | P08069 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL1904136 | 0.91 | HTT (0.35) | ALDH1A1LMNAHTTMITFMAPT | |
| SCHEMBL13953572 | 0.87 | MTNR1A (0.33) | ALDH1A1LMNAHTTMITFMAPT | |
| SCHEMBL3660804 | 0.84 | ALDH1A1 (0.35) | ALDH1A1LMNAHTTMITFMAPT | |
| SCHEMBL13953687 | 0.83 | CASR (0.38) | ALDH1A1LMNAHTTMITFMAPT | |
| SCHEMBL957448 | 0.83 | CASR (0.38) | ALDH1A1LMNAHTTMITFMAPT | |
| SCHEMBL15368397 | 0.83 | GPR139 (0.35) | ALDH1A1LMNAHTTSMN1; SMN2SLC6A2 | |
| SCHEMBL13624881 | 0.81 | LPL (0.40) | ALDH1A1LMNAHTTMITFMAPT | |
| SCHEMBL9985533 | 0.80 | SMN1; SMN2 (0.35) | ALDH1A1LMNAHTTKMT2AHTR1A | |
| SCHEMBL14865107 | 0.79 | CASR (0.34) | ALDH1A1LMNAHTTMITFMAPT | |
| SCHEMBL12670498 | 0.78 | SMN1; SMN2 (0.42) | ALDH1A1LMNAHTTMAPTKMT2A |
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-2009134387-A1 | CYCLIC INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE 1 | VITAE PHARMACEUTICALS, INC. (US) | 2009-11-05 | — | — | WO | disclosed |