Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLAU | P00749 | 1/20 | 0.49 |
| ▸ | FABP6 | P51161 | 1/20 | 0.47 |
| ▸ | PNP | P00491 | 2/20 | 0.44 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.41 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.39 |
| ▸ | MGAM | O43451 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 4/20 | 0.36 |
| ▸ | SI | P14410 | 4/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | MMP12 | P39900 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1285737 | 0.81 | HTT (0.47) | RPS6KA3MGAMGAASIMGAM2 | |
| SCHEMBL5679402 | 0.81 | NUDT1 (0.51) | FABP6PNPRPS6KA3NUDT1GAA | |
| SCHEMBL1285861 | 0.75 | MGAM (0.40) | RPS6KA3MGAMGAASIMGAM2 | |
| SCHEMBL29669307 | 0.73 | FABP6 (0.55) | PLAUFABP6PNPRPS6KA3NUDT1 | |
| SCHEMBL6622913 | 0.73 | FABP6 (0.55) | PLAUFABP6PNPRPS6KA3NUDT1 | |
| SCHEMBL13908143 | 0.73 | PNP (0.43) | FABP6PNPGAAHTTBRD4 | |
| SCHEMBL1285574 | 0.73 | BRD4 (0.45) | BRD4ALDH1A1 | |
| SCHEMBL12226843 | 0.71 | CA12 (0.44) | GAACYP3A4MAOAHTTCYP1A2 | |
| SCHEMBL6856404 | 0.70 | FABP6 (0.47) | PLAUFABP6NUDT1GAACYP3A4 | |
| SCHEMBL1286066 | 0.69 | CACNA1H (0.51) | MGAMGAASIMGAM2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1416931-A1 | INHIBITORS OF POLYQ-AGGREGATION | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2004-05-12 | — | — | EP | disclosed |
| WO-2003015772-A1 | INHIBITORS OF POLYQ-AGGREGATION | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2003-02-27 | — | — | WO | disclosed |