Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 2/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.42 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13915654 | 0.78 | KDM4E (0.62) | ALDH1A1KDM4EMAPTHTR1AADRA1D | |
| SCHEMBL29327543 | 0.77 | ALDH1A1 (0.47) | ALDH1A1KDM4EMAPTHTR1AADRA1D | |
| SCHEMBL29327547 | 0.77 | ALDH1A1 (0.47) | ALDH1A1KDM4EMAPTHTR1AADRA1D | |
| SCHEMBL19007835 | 0.77 | ALDH1A1 (0.56) | ALDH1A1KDM4EMAPTHTR1AADRA1D | |
| SCHEMBL2231455 | 0.76 | KDM4E (0.68) | ALDH1A1KDM4EMAPTHTR1AADRA1D | |
| SCHEMBL12731938 | 0.76 | MAPT (0.61) | ALDH1A1KDM4EMAPTHTR1AADRA1D | |
| SCHEMBL2229954 | 0.75 | KDM4E (0.41) | ALDH1A1KDM4EMAPTCYP3A4NR4A2 | |
| SCHEMBL3969039 | 0.75 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPTPSMB5CYP1A2 | |
| SCHEMBL10259398 | 0.75 | NQO2 (0.47) | ALDH1A1KDM4EMAPTHTR1AADRA1D | |
| SCHEMBL2229343 | 0.74 | ADRB2 (0.44) | KDM4EMAPTCYP3A4NR4A2HSP90AA1 |
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-2512478-A1 | HOMOGENEOUS SUSPENSION OF IMMUNOPOTENTIATING COMPOUNDS AND USES THEREOF | Novartis AG (CH) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011084549-A1 | HOMOGENEOUS SUSPENSION OF IMMUNOPOTENTIATING COMPOUNDS AND USES THEREOF | NOVARTIS AG (CH) | 2011-07-14 | — | — | WO | disclosed |