Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 7/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6829904 | 0.85 | NPC1 (0.39) | TP53NPC1RAB9AMAPK1MAPK14 | |
| SCHEMBL6828438 | 0.79 | L3MBTL1 (0.43) | LMNASMN1; SMN2MAPK1 | |
| SCHEMBL6828337 | 0.77 | CHEK1 (0.40) | NPC1HTTRAB9AKDM4EALDH1A1 | |
| SCHEMBL6825993 | 0.77 | ADORA3 (0.45) | TP53NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL6829284 | 0.76 | MAPK8 (0.43) | NPC1RAB9ASMN1; SMN2MAPK1 | |
| SCHEMBL6828786 | 0.74 | HPGDS (0.49) | TP53NPC1RAB9ASMN1; SMN2PTGS2 | |
| SCHEMBL6133569 | 0.73 | HDAC6 (0.45) | TP53NPC1LMNAHTTRAB9A | |
| SCHEMBL6134289 | 0.71 | KDM4E (0.44) | TP53NPC1RAB9ASMN1; SMN2HDAC6 | |
| SCHEMBL6825783 | 0.68 | ADORA1 (0.56) | MAPK1ALDH1A1 | |
| SCHEMBL6828357 | 0.67 | ADORA2A (0.51) | NPC1HTTRAB9A |
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-1441732-A2 | THIAZOLE DERIVATIVE AND PHARMACEUTICAL USE THEREOF | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-08-04 | — | — | EP | disclosed |
| WO-2003039451-A2 | THIAZOLE PYRIDAZINONES AS ADENOSINE ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2003-05-15 | — | — | WO | disclosed |