Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 2/20 | 0.41 |
| ▸ | MMP9 | P14780 | 2/20 | 0.41 |
| ▸ | MMP12 | P39900 | 2/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.41 |
| ▸ | BTK | Q06187 | 3/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12500666 | 0.81 | ALDH1A1 (0.55) | ALDH1A1TDP1LMNAKDM4EPOLB | |
| SCHEMBL28018016 | 0.80 | DYRK1A (0.52) | ALDH1A1TDP1KDM4EPIM1PIM3 | |
| SCHEMBL3105919 | 0.78 | ALDH1A1 (0.55) | ALDH1A1TDP1LMNAPOLBSLC6A2 | |
| SCHEMBL4161050 | 0.77 | ALDH1A1 (0.45) | ALDH1A1TDP1LMNAKDM4ESLC6A2 | |
| SCHEMBL28479487 | 0.75 | CHEK1 (0.46) | ALDH1A1TDP1LMNAKDM4EPOLB | |
| SCHEMBL21027365 | 0.75 | PBRM1 (0.64) | ALDH1A1TDP1LMNAPOLBMMP2 | |
| SCHEMBL21027367 | 0.75 | TDP1 (0.54) | ALDH1A1TDP1LMNAPOLBSLC6A2 | |
| SCHEMBL28058578 | 0.75 | PIM1 (0.44) | ALDH1A1PIM1PIM3BTKDYRK1A | |
| SCHEMBL27982582 | 0.75 | PIM1 (0.49) | ALDH1A1PIM1PIM3BTKDYRK1A | |
| SCHEMBL27763175 | 0.74 | ALDH1A1 (0.47) | ALDH1A1TDP1LMNAPOLBSLC6A2 |
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-2621544-A1 | IN VIVO IMAGING METHOD FOR CANCER | GE Healthcare UK Limited (GB) | 2013-08-07 | — | — | EP | disclosed |
| WO-2012041953-A1 | IN VIVO IMAGING METHOD FOR CANCER | GE HEALTHCARE LIMITED (GB) | 2012-04-05 | — | — | WO | disclosed |