Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 2/20 | 0.38 |
| ▸ | KDR | P35968 | 2/20 | 0.38 |
| ▸ | TEK | Q02763 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5602271 | 0.90 | HTT (0.43) | HTTTSHRCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL4414236 | 0.88 | NAMPT (0.43) | HTTTSHRNPC1RAB9ACYP1A2 | |
| SCHEMBL4551630 | 0.88 | GRM4 (0.43) | HTTTSHRNPC1RAB9AKDR | |
| SCHEMBL4407836 | 0.81 | NR1H4 (0.45) | HTTKMT2ALMNABRAFMAPT | |
| SCHEMBL4417707 | 0.80 | CYP3A4 (0.43) | HTTTSHRRAB9ACYP1A2CYP3A4 | |
| SCHEMBL5593328 | 0.78 | RXFP1 (0.43) | HTTTSHRKMT2AMEN1BRAF | |
| SCHEMBL5592971 | 0.77 | RXFP1 (0.42) | HTTTSHRCYP1A2KMT2AMEN1 | |
| SCHEMBL5602261 | 0.76 | HTT (0.43) | HTTTSHRCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL4551631 | 0.76 | GRM4 (0.49) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL5592986 | 0.76 | RXFP1 (0.41) | HTTTSHRKMT2AMEN1LMNA |
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-2007075896-A2 | HETEROCYCLIC CYTOKINE INHIBITORS | KEMIA, INC. (US) | 2007-07-05 | — | — | WO | disclosed |