Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 4/20 | 0.39 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CA4 | P22748 | 3/20 | 0.39 |
| ▸ | CA5A | P35218 | 3/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA3 | P07451 | 2/20 | 0.33 |
| ▸ | CA6 | P23280 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CA11 | O75493 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11560822 | 0.86 | CYP3A4 (0.55) | CYP3A4CA1CA2CA4CA5A | |
| SCHEMBL10823739 | 0.86 | CYP3A4 (0.59) | CYP3A4CA1CA2CA4CA5A | |
| SCHEMBL11562967 | 0.86 | CYP3A4 (0.55) | CYP3A4CA1CA2CA4CA5A | |
| SCHEMBL11800909 | 0.86 | CYP3A4 (0.55) | CYP3A4CA1CA2CA4CA5A | |
| SCHEMBL134172 | 0.84 | CYP3A4 (0.54) | CYP3A4CA1CA2CA4CA5A | |
| SCHEMBL8539346 | 0.84 | CYP3A4 (0.54) | CYP3A4CA1CA2CA4CA5A | |
| SCHEMBL11563590 | 0.81 | CYP3A4 (0.50) | CYP3A4CA1CA2CA4CA5A | |
| SCHEMBL11620991 | 0.81 | CYP3A4 (0.50) | CYP3A4CA1CA2CA4CA5A | |
| SCHEMBL11620993 | 0.81 | CYP3A4 (0.50) | CYP3A4CA1CA2CA4CA5A | |
| SCHEMBL11561106 | 0.81 | CYP3A4 (0.50) | CYP3A4LMNATHRBKMT2A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4876044-A | PESTICIDES, HERBICIDES | AIR PRODUCTS AND CHEMICALS, INC. | 1989-10-24 | — | — | US | disclosed |
| US-4165229-A | SUBSTITUTED THIADIAZOL-2-YLUREA | ELI LILLY AND COMPANY (US) | 1979-08-21 | — | — | US | disclosed |
| US-4128412-A | Herbicidal composition and method using N-(2-ethylsulfonyl-1,3,4-thiadiazol-5-yl)-N-methyl-N'-methyl urea | BAYER AKTIENGESELLSCHAFT (DE) | 1978-12-05 | — | — | US | disclosed |
| US-4056382-A | THIADIAZOLYLUREA | ELI LILLY AND COMPANY (US) | 1977-11-01 | — | — | US | disclosed |
| US-4049670-A | HERBICIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-20 | — | — | US | disclosed |
| US-3972706-A | SUBSTITUTED THIADIAZOL-2-YL-UREAS | ELI LILLY AND COMPANY (US) | 1976-08-03 | — | — | US | disclosed |