Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.65 |
| ▸ | RAB9A | P51151 | 8/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.65 |
| ▸ | MAPT | P10636 | 5/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.65 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.65 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.65 |
| ▸ | RELA | Q04206 | 2/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.61 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 2/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | GFER | P55789 | 2/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.52 |
| ▸ | UTRN | P46939 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL14707163 | 0.90 | NPC1 (0.62) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL30296114 | 0.90 | NPC1 (0.62) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL2244350 | 0.89 | NPC1 (0.65) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL28299061 | 0.87 | NPC1 (0.60) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL4509718 | 0.86 | NPC1 (0.69) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL28264769 | 0.86 | NPC1 (0.58) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL31170969 | 0.84 | PTPN2 (0.62) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL2270976 | 0.84 | NPC1 (0.78) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL29364223 | 0.84 | NPC1 (0.78) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL2247289 | 0.82 | RAB9A (0.74) | NPC1RAB9AKDM4EMAPTALDH1A1 |
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-2004067480-A2 | SUBSTITUTED PHENYLUREA DERIVATIVES AS HDAC INHIBITORS | OXFORD GLYCOSCIENCES (UK) LTD (GB) | 2004-08-12 | — | — | WO | disclosed |