Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 6/20 | 0.58 |
| ▸ | TTR | P02766 | 2/20 | 0.49 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7247792 | 0.91 | TTR (0.60) | GPR35TTRCA12CA1CA2 | |
| SCHEMBL11801800 | 0.90 | GPR35 (0.56) | GPR35TTRESR1VCAM1 | |
| SCHEMBL11806426 | 0.81 | GPR35 (0.53) | GPR35TTRESR1CRHBPCRHR2 | |
| SCHEMBL11797339 | 0.81 | GPR35 (0.53) | GPR35TTRESR1CRHBPCRHR2 | |
| SCHEMBL11796758 | 0.80 | GPR35 (0.56) | GPR35TTRCA1CA2 | |
| SCHEMBL4893026 | 0.79 | GPR35 (0.69) | GPR35TTRCRHBPCRHR2CA12 | |
| SCHEMBL28032804 | 0.78 | VCAM1 (0.41) | GPR35TTRVCAM1 | |
| SCHEMBL6740307 | 0.77 | VCAM1 (0.70) | VCAM1 | |
| SCHEMBL10483661 | 0.77 | CYP3A4 (0.57) | — | |
| SCHEMBL503443 | 0.76 | CASP6 (0.62) | GPR35TTRCRHBPCRHR2 |
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-3933472-A | Substituted alkylaryl ketones and methods of use as herbicides | BUCKMAN LABORATORIES, INC. (US) | 1976-01-20 | — | — | US | disclosed |