Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 6/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | UBE2M | P61081 | 1/20 | 0.33 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11749623 | 0.83 | CHEK1 (0.41) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL11535133 | 0.77 | BRPF1 (0.42) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL11538052 | 0.77 | CHEK1 (0.58) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| Bromide SCHEMBL11744403 | 0.76 | CHEK1 (0.57) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL11748057 | 0.68 | BRPF1 (0.53) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL11743929 | 0.63 | CHEK1 (0.66) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL11538651 | 0.62 | GRM2 (0.37) | GRM2ALDH1A1HSD11B1HTTSMN1; SMN2 | |
| SCHEMBL11744435 | 0.60 | BRPF1 (0.55) | CHEK1PDGFRACDK5DYRK1ALRRK2 | |
| SCHEMBL17620981 | 0.58 | MAPK1 (0.40) | TSHRMAPK1MEN1KMT2ARXFP1 | |
| SCHEMBL11537005 | 0.58 | HCAR1 (0.47) | GRM2ALDH1A1HTTALOX15HSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4134914-A | 1-Acyl-4-substituted phenyl thiosemicarbazides | ELI LILLY AND COMPANY (US) | 1979-01-16 | — | — | US | disclosed |
| US-4082762-A | 4-(2-HALOPHENYL)-1,2,4-TRIAZOLE-3-THIOL COMPOUNDS | ELI LILLY AND COMPANY (US) | 1978-04-04 | — | — | US | disclosed |
| US-3937713-A | Process for the preparation of s-triazolo[3,4-b]benzothiazoles | ELI LILLY AND COMPANY (US) | 1976-02-10 | — | — | US | disclosed |