Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | TERT | O14746 | 1/20 | 0.44 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | MMP12 | P39900 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13340948 | 0.83 | MAOB (0.38) | HTTTSHRPOLBMAPTHSD17B10 | |
| SCHEMBL30921780 | 0.83 | PIK3CD (0.46) | CYP3A4CYP2D6MEN1KMT2AGAA | |
| SCHEMBL14615641 | 0.83 | SLC5A1 (0.43) | HTTTERTMAPTHSD17B10PIK3CD | |
| SCHEMBL13962148 | 0.83 | CYP11B2 (0.36) | HTTTSHRCYP2D6CYP11B1CYP11B2 | |
| SCHEMBL15798686 | 0.80 | HTT (0.48) | HTTTSHRPLK1CYP3A4CYP2D6 | |
| SCHEMBL7350158 | 0.79 | ALOX12 (0.47) | TSHRCYP2D6CYP2C19POLBMEN1 | |
| SCHEMBL5985192 | 0.79 | CYP11B2 (0.55) | HTTTSHRTERTPLK1MMP12 | |
| SCHEMBL18937271 | 0.79 | TERT (0.48) | HTTTERTCYP3A4CYP2C19CYP1A2 | |
| SCHEMBL8039853 | 0.76 | SMN1; SMN2 (0.44) | HTTPOLBALDH1A1MAPTHSD17B10 | |
| SCHEMBL18937270 | 0.76 | MAPT (0.47) | HTTTSHRCYP2C19CYP1A2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8993585-B2 | Cyclic amine substituted pyrimidinediamines as PKC inhibitors | RIGEL PHARMACEUTICALS, INC. (US) | 2015-03-31 | — | — | US | disclosed |