Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 5/20 | 0.42 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | EGFR | P00533 | 4/20 | 0.39 |
| ▸ | ERBB2 | P04626 | 4/20 | 0.39 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.36 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2909498 | 0.83 | MAOB (0.48) | CTSBCTSSCTSKMAOBRIPK1 | |
| SCHEMBL8843784 | 0.77 | CTSB (0.46) | CTSBCTSSCTSKMAOBRIPK1 | |
| SCHEMBL15125610 | 0.75 | CTSB (0.47) | CTSBCTSSCTSKCA12CA1 | |
| SCHEMBL7456824 | 0.74 | RIPK1 (0.44) | CTSBCTSSCTSKMAOBRIPK1 | |
| SCHEMBL30561266 | 0.73 | EGFR (0.50) | CTSBCTSSCTSKMAOBEGFR | |
| SCHEMBL26196734 | 0.73 | EGFR (0.50) | CTSBCTSSCTSKMAOBEGFR | |
| SCHEMBL6069235 | 0.73 | CA1 (0.45) | MAOBEGFRERBB2CA12CA1 | |
| SCHEMBL609893 | 0.72 | MAOB (0.51) | MAOBRIPK1MAOAEGFRERBB2 | |
| SCHEMBL1295692 | 0.72 | CTSB (0.52) | CTSBCTSSCTSKRIPK1EGFR | |
| SCHEMBL29438244 | 0.71 | RIPK1 (0.48) | CTSBCTSSCTSKMAOBRIPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023284837-A1 | ARYLAMINO DERIVATIVE ESTROGEN RECEPTOR MODULATOR AND USE THEREOF | 四川海思科制药有限公司 | 2023-01-19 | — | — | WO | disclosed |