Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | KDM2B | Q8NHM5 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MGLL | Q99685 | 2/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL16348220 | 0.90 | POLB (0.59) | HTTPOLBKMT2AMEN1CYP2D6 | |
| SCHEMBL8119800 | 0.81 | KMT2A (0.68) | HTTPOLBKMT2AMEN1CYP2D6 | |
| SCHEMBL20134881 | 0.80 | POLB (0.62) | HTTPOLBKMT2AMEN1CYP2D6 | |
| SCHEMBL507614 | 0.79 | KMT2A (0.66) | HTTPOLBKMT2AMEN1CYP2D6 | |
| SCHEMBL728685 | 0.77 | KMT2A (0.72) | HTTPOLBKMT2AMEN1CYP2D6 | |
| Bicarbonate SCHEMBL11484457 | 0.73 | KMT2A (0.68) | HTTPOLBKMT2AMEN1CYP2D6 | |
| SCHEMBL16342269 | 0.73 | MGLL (0.45) | POLBKMT2AMEN1ALDH1A1MGLL | |
| SCHEMBL14297351 | 0.73 | PDK2 (0.45) | POLBKMT2AMEN1ALDH1A1LMNA | |
| SCHEMBL29588286 | 0.73 | SLC18A3 (0.45) | HTTKMT2AMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL19751086 | 0.73 | RIPK1 (0.47) | KMT2AMEN1MGLLHSD11B1 |
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-2021003295-A1 | MODULATORS OF HSD17B13 AND METHODS OF USE THEREOF | REGENERON PHARMACEUTICALS, INC. (US) | 2021-01-07 | — | — | WO | disclosed |