Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | STK33 | Q9BYT3 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.44 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.44 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16627785 | 0.87 | TOP1 (0.48) | PARP1KDM4EPARP14NPC1RAB9A | |
| SCHEMBL16627819 | 0.85 | BRD4 (0.54) | PARP1PARP14BRD4NPC1CYP1A2 | |
| SCHEMBL16627818 | 0.78 | RXFP1 (0.53) | PARP1BRD4NPC1RAB9AMAPT | |
| SCHEMBL16627598 | 0.75 | SMYD3 (0.54) | KDM4EBRD4ALDH1A1TSHRHSD17B10 | |
| SCHEMBL10813245 | 0.72 | PARP1 (0.57) | PARP1KDM4EPARP14BRD4NPC1 | |
| SCHEMBL16627806 | 0.72 | NHERF1 (0.49) | PARP1KDM4ESTK33MAPTALDH1A1 | |
| SCHEMBL16627879 | 0.71 | MAPT (0.51) | PARP1KDM4ENPC1RAB9ASTK33 | |
| SCHEMBL16627787 | 0.70 | PARP14 (0.47) | KDM4EPARP14NPC1CYP2C9RAB9A | |
| SCHEMBL16627688 | 0.70 | MAPT (0.50) | KDM4ENPC1RAB9AMAPTALDH1A1 | |
| SCHEMBL16627783 | 0.70 | PARP14 (0.47) | KDM4EPARP14NPC1CYP2C9RAB9A |
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-2015050379-A1 | NOVEL QUINOLINONE DERIVATIVE AND USE THEREOF | 광주과학기술원 | 2015-04-09 | — | — | WO | disclosed |