Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | F10 | P00742 | 16/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | KLKB1 | P03952 | 3/20 | 0.46 |
| ▸ | MITF | O75030 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3160329 | 1.00 | NPC1 (0.58) | NPC1RAB9AKDM4EF10KMT2A | |
| SCHEMBL3161375 | 0.98 | NPC1 (0.57) | NPC1RAB9AKDM4EF10KMT2A | |
| SCHEMBL3160045 | 0.94 | NPC1 (0.55) | NPC1RAB9AKDM4EF10KMT2A | |
| SCHEMBL3157546 | 0.92 | NPC1 (0.54) | NPC1RAB9AKDM4EF10KMT2A | |
| SCHEMBL4279973 | 0.89 | NPC1 (0.55) | NPC1RAB9AKDM4EF10KMT2A | |
| SCHEMBL3152095 | 0.89 | F10 (0.55) | F10KLKB1KCNH2 | |
| SCHEMBL4285191 | 0.89 | NPC1 (0.54) | NPC1RAB9AKDM4EF10KMT2A | |
| SCHEMBL4268954 | 0.87 | NPC1 (0.54) | NPC1RAB9AKDM4EF10KMT2A | |
| SCHEMBL3161363 | 0.87 | F10 (0.53) | F10KLKB1KCNH2 | |
| SCHEMBL3160286 | 0.87 | F10 (0.58) | F10KLKB1 |
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-1817287-A1 | AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS | Eli Lilly and Company (US) | 2007-08-15 | — | — | EP | disclosed |
| WO-2006057845-A1 | AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS | ELI LILLY AND COMPANY (US) | 2006-06-01 | — | — | WO | disclosed |