Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
| ▸ | CDK7 | P50613 | 1/20 | 0.32 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | TTBK1 | Q5TCY1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21614691 | 0.85 | RECQL (0.34) | SMN1; SMN2MEN1HPGDKMT2ASCN9A | |
| SCHEMBL21614755 | 0.70 | IDO1 (0.31) | — | |
| SCHEMBL21614681 | 0.70 | USP36 (0.40) | HPGDSCN5ASCN9ARECQLCDK8 | |
| SCHEMBL21614671 | 0.69 | GRK2 (0.34) | HPGDRECQLNR3C1PGRAR | |
| SCHEMBL21614629 | 0.69 | RECQL (0.36) | SMN1; SMN2MEN1KMT2ARECQLNR3C1 | |
| SCHEMBL21611990 | 0.66 | GRIN1 (0.43) | SMN1; SMN2MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL21614704 | 0.66 | RECQL (0.38) | SMN1; SMN2MEN1HPGDKMT2ASCN9A | |
| SCHEMBL21611964 | 0.65 | CYP3A4 (0.50) | — | |
| SCHEMBL21614722 | 0.65 | RAB9A (0.32) | SCN9ARAB9AKDM4E | |
| SCHEMBL21611947 | 0.65 | PPARD (0.40) | SMN1; SMN2ALDH1A1LMNAHTTRAB9A |
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-2020007938-A1 | PqsR INVERSE AGONISTS | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2020-01-09 | — | — | WO | disclosed |