Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.50 |
| ▸ | NPC1 | O15118 | 5/20 | 0.50 |
| ▸ | KDR | P35968 | 2/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.45 |
| ▸ | BTK | Q06187 | 3/20 | 0.45 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.45 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.44 |
| ▸ | TCF7L2 | Q9NQB0 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL790392 | 0.93 | KDR (0.48) | RAB9ANPC1KDRTP53MAPT | |
| SCHEMBL790093 | 0.93 | SMN1; SMN2 (0.48) | RAB9ANPC1KDRTP53MAPT | |
| SCHEMBL791145 | 0.92 | KDR (0.46) | RAB9ANPC1KDRTP53MAPT | |
| SCHEMBL790416 | 0.88 | MRGPRX4 (0.50) | RAB9AKDRMAPTLMNATSHR | |
| SCHEMBL790646 | 0.88 | KDR (0.47) | RAB9AKDRMAPTLMNAKDM4E | |
| SCHEMBL791199 | 0.83 | RAB9A (0.50) | RAB9AKDRLMNA | |
| SCHEMBL790788 | 0.80 | NPC1 (0.54) | RAB9ANPC1BTK | |
| SCHEMBL790621 | 0.80 | KDR (0.46) | RAB9ANPC1KDRMAPTLMNA | |
| SCHEMBL789889 | 0.77 | RAB9A (0.48) | RAB9AKDRMAPK1 | |
| SCHEMBL789721 | 0.73 | MAPK14 (0.51) | RAB9ANPC1MAPTSMN1; SMN2BTK |
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-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |