Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.45 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | CFTR | P13569 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4797120 | 0.75 | GRM1 (0.59) | NPC1KDM4EGRM1RAB9AMAPT | |
| SCHEMBL4798879 | 0.73 | NPC1 (0.59) | NPC1KDM4EGRM1RAB9AMAPT | |
| SCHEMBL20791859 | 0.70 | NPC1 (0.76) | NPC1KDM4ETDP1FFAR2RAB9A | |
| SCHEMBL3345136 | 0.69 | MAPT (0.50) | NPC1KDM4ETDP1GRM1RAB9A | |
| SCHEMBL3340907 | 0.68 | KDM4E (1.00) | NPC1KDM4ETDP1FFAR2RAB9A | |
| SCHEMBL10931661 | 0.68 | UCHL1 (0.49) | NPC1KDM4ETDP1GRM1RAB9A | |
| SCHEMBL8167107 | 0.67 | CES2 (0.45) | NPC1KDM4ERAB9AMAPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11830537 | 0.65 | TP53 (0.56) | NPC1KDM4ETDP1RAB9AMAPT | |
| SCHEMBL4798176 | 0.65 | GRM1 (0.55) | NPC1KDM4EGRM1RAB9AMAPT | |
| SCHEMBL10591755 | 0.64 | ELANE (0.42) | NPC1KDM4ETDP1RAB9AMAPT |
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-2008052804-A1 | THIAZOLHYDRAZIDES FOR TREATMENT OF NEURODEGENERATIVE DISEASES | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2008-05-08 | — | — | WO | disclosed |