Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | PLK1 | P53350 | 1/20 | 0.49 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL13091199 | 0.88 | TSHR (0.67) | HTTTSHRPLK1POLBTP53 | |
| SCHEMBL16601596 | 0.88 | TSHR (0.55) | HTTTSHRPLK1POLBTP53 | |
| SCHEMBL13367640 | 0.87 | TSHR (0.51) | HTTTSHRPLK1CHRM5CHRM1 | |
| SCHEMBL10196932 | 0.85 | TSHR (0.55) | HTTTSHRPLK1POLBTP53 | |
| SCHEMBL4089728 | 0.85 | POLB (0.50) | HTTTSHRPLK1CHRM5CHRM1 | |
| SCHEMBL16522709 | 0.84 | CHRM1 (0.47) | HTTTSHRCHRM5CHRM1CHRM3 | |
| SCHEMBL10619000 | 0.84 | CHRM1 (0.64) | HTTCHRM5CHRM1CHRM3ALDH1A1 | |
| SCHEMBL13961733 | 0.84 | CHRM5 (0.47) | HTTTSHRCHRM5CHRM1CHRM3 | |
| SCHEMBL13340944 | 0.82 | HTT (0.47) | HTTTSHRCHRM5CHRM1CHRM3 | |
| SCHEMBL10849516 | 0.82 | L3MBTL1 (0.53) | HTTTSHRCHRM5CHRM1CHRM3 |
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 |