Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | XDH | P47989 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.34 |
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MC4R | P32245 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL4727852 | 0.72 | KMT2A (0.35) | POLBKDM4ELMNAMEN1KMT2A | |
| SCHEMBL19122481 | 0.63 | BRD4 (0.42) | BRD4CREBBPPOLBKDM4EALDH1A1 | |
| SCHEMBL25740878 | 0.62 | ACHE (0.43) | POLBKDM4EALDH1A1LMNAMAOB | |
| SCHEMBL123415 | 0.61 | MAPT (0.55) | POLBKDM4EALDH1A1LMNAMAOA | |
| SCHEMBL7528009 | 0.60 | MAPT (0.47) | POLBKDM4EALDH1A1LMNAMAOA | |
| SCHEMBL4024350 | 0.60 | MAOA (0.38) | ALDH1A1MAOBMAOASIGMAR1HTR2B | |
| SCHEMBL16624056 | 0.59 | PDK2 (0.39) | BRD4CREBBPPOLBKDM4EALDH1A1 | |
| SCHEMBL19122980 | 0.59 | BRD4 (0.39) | BRD4CREBBPPOLBKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL17965612 | 0.58 | PDK2 (0.38) | BRD4CREBBPPOLBKDM4EALDH1A1 | |
| SCHEMBL2967940 | 0.58 | TRIM24 (0.55) | POLBKDM4ELMNASMN1; SMN2PDK2 |
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-2013059582-A2 | SMALL MOLECULE INHIBITORS OF HISTONE DEACTEYLASES | NUPOTENTIAL, INC. (US) | 2013-04-25 | — | — | WO | disclosed |