Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 12/20 | 0.40 |
| ▸ | CA12 | O43570 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 4/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.33 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
| ▸ | UGT1A7 | Q9HAW7 | 1/20 | 0.33 |
| ▸ | SLC22A11 | Q9NSA0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11561106 | 0.92 | CYP3A4 (0.50) | CYP3A4MAPTLMNATP53THRB | |
| SCHEMBL11562898 | 0.90 | CYP3A4 (0.44) | CYP3A4MAPTLMNATP53THRB | |
| SCHEMBL11561634 | 0.87 | CYP3A4 (0.48) | CYP3A4MAPTCA12CA9CA1 | |
| SCHEMBL11559487 | 0.85 | CYP3A4 (0.44) | CYP3A4MAPTLMNATP53THRB | |
| SCHEMBL11560409 | 0.84 | CYP3A4 (0.50) | CYP3A4MAPTLMNATP53THRB | |
| SCHEMBL11561919 | 0.82 | CYP3A4 (0.46) | CYP3A4MAPTLMNATP53THRB | |
| SCHEMBL10823739 | 0.81 | CYP3A4 (0.59) | CYP3A4MAPTCA12CA9CA1 | |
| SCHEMBL134172 | 0.80 | CYP3A4 (0.54) | CYP3A4MAPTCA12CA9CA1 | |
| SCHEMBL8539346 | 0.80 | CYP3A4 (0.54) | CYP3A4MAPTCA12CA9CA1 | |
| SCHEMBL11563590 | 0.79 | CYP3A4 (0.50) | CYP3A4MAPTCA12CA9CA1 |
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-4165229-A | SUBSTITUTED THIADIAZOL-2-YLUREA | ELI LILLY AND COMPANY (US) | 1979-08-21 | — | — | US | disclosed |