Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | PKLR | P30613 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 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 | |
|---|---|---|---|---|
| SCHEMBL13908095 | 0.81 | CYP2C9 (0.42) | ALDH1A1CYP2C9CYP2C19KMT2ATSHR | |
| SCHEMBL10282914 | 0.81 | CYP2C9 (0.55) | ALDH1A1CYP2C9CYP2C19KMT2ATSHR | |
| SCHEMBL1103999 | 0.78 | ALDH1A1 (0.51) | ALDH1A1CYP2C9CYP2C19KMT2ATSHR | |
| SCHEMBL895814 | 0.78 | MAOB (0.52) | ALDH1A1CYP3A4NPC1RAB9AGRIN1 | |
| Hydrochloric Acid SCHEMBL18742650 | 0.76 | MAOB (0.50) | ALDH1A1CYP3A4NPC1RAB9AGRIN1 | |
| SCHEMBL23647557 | 0.76 | KMT2A (0.51) | ALDH1A1CYP2C9CYP2C19KMT2ATSHR | |
| SCHEMBL11972187 | 0.75 | SLC6A4 (0.51) | GRIN1GRIN2AGRIN2B | |
| SCHEMBL20901036 | 0.73 | SLC6A4 (0.59) | GRIN1GRIN2AGRIN2B | |
| Hydrochloric Acid SCHEMBL17315608 | 0.73 | SLC6A4 (0.54) | GRIN1GRIN2AGRIN2B | |
| SCHEMBL20901037 | 0.73 | SLC6A4 (0.59) | GRIN1GRIN2AGRIN2B |
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-2009038974-A1 | COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY | IRM LLC (BM) | 2009-03-26 | — | — | WO | disclosed |