Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.71 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | CCR6 | P51684 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | HTR2B | P41595 | 1/20 | 0.56 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | CASP1 | P29466 | 1/20 | 0.55 |
| ▸ | CASP7 | P55210 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL10722320 | 0.88 | HTT (0.89) | HTTMAPTNPSR1CCR6ALDH1A1 | |
| SCHEMBL12333385 | 0.84 | HRH4 (0.55) | HTTALDH1A1USP2TSHRHSD11B1 | |
| SCHEMBL14825166 | 0.83 | HTT (1.00) | HTTMAPTNPSR1ALDH1A1CYP2C9 | |
| SCHEMBL4548030 | 0.81 | HTT (0.77) | HTTMAPTNPSR1CCR6ALDH1A1 | |
| SCHEMBL3088384 | 0.81 | HTT (0.77) | HTTMAPTNPSR1CCR6ALDH1A1 | |
| SCHEMBL11960839 | 0.81 | SMN1; SMN2 (0.52) | HTTMAPTALDH1A1USP2TSHR | |
| SCHEMBL30530619 | 0.81 | HTT (0.89) | HTTMAPTNPSR1ALDH1A1CYP2C9 | |
| SCHEMBL13162411 | 0.81 | HTT (0.96) | HTTMAPTNPSR1ALDH1A1CYP2C9 | |
| SCHEMBL1520613 | 0.81 | HTT (0.89) | HTTMAPTNPSR1ALDH1A1CYP2C9 | |
| SCHEMBL12305558 | 0.80 | HSD11B1 (0.49) | HTTMAPTALDH1A1HSD11B1MEN1 |
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-8431713-B2 | 2-aminopyridine derivatives as glucokinase activators | ARRAY BIOPHARMA, INC. (US) | 2013-04-30 | — | — | US | disclosed |