Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.40 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.37 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | TYK2 | P29597 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5054669 | 1.00 | NPC1 (0.42) | NPC1RAB9ASAE1UBA2KDM4E | |
| SCHEMBL1496794 | 0.91 | NPC1 (0.42) | NPC1RAB9ASAE1UBA2KDM4E | |
| SCHEMBL1613189 | 0.91 | NPC1 (0.42) | NPC1RAB9ASAE1UBA2KDM4E | |
| SCHEMBL5173867 | 0.82 | SMN1; SMN2 (0.45) | NPC1RAB9AALDH1A1TP53GAA | |
| SCHEMBL1549279 | 0.82 | SMN1; SMN2 (0.45) | NPC1RAB9AALDH1A1TP53GAA | |
| SCHEMBL2446775 | 0.81 | TYK2 (0.40) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL2344006 | 0.76 | DHODH (0.52) | RAB9AKDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL1549524 | 0.76 | DHODH (0.52) | RAB9AKDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL2446783 | 0.74 | NPC1 (0.39) | NPC1RAB9AALDH1A1TP53GAA | |
| SCHEMBL2348121 | 0.73 | NPC1 (0.44) | NPC1RAB9AALDH1A1TP53GAA |
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-1967519-B1 | 3,4-DIHYDROBENZOXAZINE COMPOUND AND INHIBITOR OF VANILLOID RECEPTOR TYPE 1 (VR1) ACTIVITY | JAPAN TOBACCO INC (JP) | 2012-09-05 | — | — | EP | disclosed |
| EP-1967519-A1 | 3,4-DIHYDROBENZOXAZINE COMPOUND AND INHIBITOR OF VANILLOID RECEPTOR TYPE 1 (VR1) ACTIVITY | JAPAN TOBACCO INC. (JP) | 2008-09-10 | — | — | EP | disclosed |