Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | BTK | Q06187 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CHKA | P35790 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | PDE1A | P54750 | 1/20 | 0.41 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6982244 | 0.76 | KDM4E (0.64) | ALDH1A1KDM4EMAPTTSHRHPGD | |
| SCHEMBL6976973 | 0.73 | KDM4E (0.57) | ALDH1A1KDM4EMAPTKMT2ATSHR | |
| SCHEMBL15616400 | 0.73 | MAPK14 (0.53) | KDM4EMAPTRORC | |
| SCHEMBL6978588 | 0.73 | KDM4E (0.59) | ALDH1A1KDM4EMAPTPOLBKMT2A | |
| SCHEMBL15555148 | 0.72 | RORC (0.79) | RORC | |
| SCHEMBL30031951 | 0.72 | MAPT (0.58) | ALDH1A1KDM4EMAPTALOX15HPGD | |
| SCHEMBL13503830 | 0.71 | HPGD (0.73) | ALDH1A1POLBKMT2ATSHRLMNA | |
| SCHEMBL19908274 | 0.71 | POLB (0.51) | POLBCHKAHPGD | |
| SCHEMBL15880007 | 0.71 | CRBN (0.56) | ALDH1A1MAPTPOLBKMT2ATSHR | |
| SCHEMBL30226880 | 0.70 | CRBN (0.58) | ALDH1A1KDM4EMAPTTSHRALOX15 |
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-2014008214-A1 | BIARYL-CONTAINING COMPOUNDS AS INVERSE AGONISTS OF ROR-GAMMA RECEPTORS | BIOGEN IDEC MA INC. (US) | 2014-01-09 | — | — | WO | disclosed |