Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.54 |
| ▸ | CTSK | P43235 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | PRKCA | P17252 | 1/20 | 0.51 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.51 |
| ▸ | LTA4H | P09960 | 2/20 | 0.51 |
| ▸ | BCL2 | P10415 | 1/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | YAP1 | P46937 | 1/20 | 0.48 |
| ▸ | SYK | P43405 | 1/20 | 0.48 |
| ▸ | ACACB | O00763 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL2574965 | 1.00 | CTSS (0.54) | CTSSCTSKNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2574963 | 1.00 | CTSS (0.54) | CTSSCTSKNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL192406 | 0.93 | CTSS (0.54) | CTSSCTSKATMPRKCAPRKCD | |
| SCHEMBL192405 | 0.93 | CTSS (0.54) | CTSSCTSKATMPRKCAPRKCD | |
| SCHEMBL191550 | 0.92 | ATM (0.55) | CTSSCTSKNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL191549 | 0.92 | ATM (0.55) | CTSSCTSKNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28425078 | 0.90 | FFAR1 (0.52) | CTSSCTSKBCL2PTPN1YAP1 | |
| SCHEMBL23200772 | 0.90 | PPARA (0.52) | CTSSCTSKATMBCL2SYK | |
| SCHEMBL20439330 | 0.87 | CTSS (0.48) | CTSSCTSKNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL2295053 | 0.86 | CTSS (0.52) | CTSSCTSKATMACACBPPARA |
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-2018138739-A1 | NOVEL ANTIESTROGENIC HETEROCYCLIC COMPOUNDS | SUN PHARMA ADVANCED RESEARCH COMPANY LIMITED (IN) | 2018-08-02 | — | — | WO | disclosed |