Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.60 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.60 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.60 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.60 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.60 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.60 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | BRD4 | O60885 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | POLB | P06746 | 4/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11744815 | 0.83 | CHEK1 (0.60) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL11746654 | 0.83 | CHEK1 (0.53) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL11534725 | 0.82 | CHEK1 (0.51) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| Hydrochloric Acid SCHEMBL11744919 | 0.81 | RECQL (0.56) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL11536976 | 0.77 | CHEK1 (0.66) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL11746758 | 0.76 | RECQL (0.69) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL11747298 | 0.76 | CHEK1 (0.55) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| Hydrochloric Acid SCHEMBL11747896 | 0.76 | CHEK1 (0.64) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL11537644 | 0.75 | HSD17B10 (0.41) | CYP1A2CYP2C9ALDH1A1BRD4RAB9A | |
| SCHEMBL11747499 | 0.74 | CHEK1 (0.53) | CHEK1PDGFRACDK5DYRK1ALRRK2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4064261-A | TRIAZOLOBENOXAZOLE, TRIAZOLOBENZOTHIAZOLE COMPOUNDS | ELI LILLY AND COMPANY (US) | 1977-12-20 | — | — | US | disclosed |