Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 10/20 | 0.60 |
| ▸ | POLB | P06746 | 4/20 | 0.60 |
| ▸ | HTT | P42858 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.52 |
| ▸ | USP2 | O75604 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.49 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.49 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL23440431 | 0.91 | NPSR1 (0.60) | HPGDPOLBHTTMAPTSMN1; SMN2 | |
| SCHEMBL23440341 | 0.89 | SMN1; SMN2 (0.61) | HPGDPOLBHTTMAPTSMN1; SMN2 | |
| SCHEMBL23440433 | 0.89 | TDP1 (0.58) | HPGDPOLBHTTMAPTSMN1; SMN2 | |
| SCHEMBL23440348 | 0.85 | HPGD (0.60) | HPGDPOLBHTTMAPTSMN1; SMN2 | |
| SCHEMBL23440346 | 0.84 | HPGD (0.56) | HPGDPOLBHTTMAPTSMN1; SMN2 | |
| SCHEMBL23440117 | 0.81 | HPGD (0.51) | HPGDPOLBHTTMAPTSMN1; SMN2 | |
| SCHEMBL23439800 | 0.81 | HPGD (0.51) | HPGDPOLBHTTMAPTSMN1; SMN2 | |
| SCHEMBL23412537 | 0.79 | HPGD (0.71) | HPGDPOLBHTTMAPTSMN1; SMN2 | |
| SCHEMBL16676602 | 0.76 | HPGD (0.66) | HPGDPOLBHTTMAPTSMN1; SMN2 | |
| SCHEMBL31092083 | 0.76 | HPGD (1.00) | HPGDPOLBHTTMAPTSMN1; SMN2 |
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-2021105906-A1 | ARYL AND HETEROARYL COMPOUNDS, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF GALACTOCEREBROSIDASE | GAIN THERAPEUTICS SA (CH) | 2021-06-03 | — | — | WO | disclosed |