Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 5/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | USP7 | Q93009 | 4/20 | 0.40 |
| ▸ | QDPR | P09417 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | WEE1 | P30291 | 1/20 | 0.37 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7968684 | 0.82 | PARP1 (0.43) | PARP1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL2589997 | 0.82 | CDC7 (0.48) | PARP1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL3728479 | 0.82 | PARP1 (0.43) | PARP1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL2595517 | 0.82 | TLR9 (0.48) | PARP1NPC1RAB9AQDPRTLR9 | |
| SCHEMBL2111216 | 0.82 | NPC1 (0.58) | PARP1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL1298735 | 0.82 | PARP1 (0.49) | PARP1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL14447538 | 0.82 | NPC1 (0.51) | PARP1NPC1RAB9AKDM4EMAPT | |
| SCHEMBL14447528 | 0.82 | KDM4E (0.57) | PARP1NPC1RAB9AKDM4EMAPT | |
| Hydrochloric Acid SCHEMBL1981017 | 0.81 | CDC7 (0.47) | PARP1NPC1RAB9AKDM4EMAPT | |
| Hydrochloric Acid SCHEMBL1299402 | 0.81 | PARP1 (0.48) | PARP1NPC1RAB9AKDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6660751-B1 | Sulfonamide derivatives as 5-HT7 receptor antagonists | SMITHKLINE BEECHAM P.L.C. (GB) | 2003-12-09 | — | — | US | disclosed |