Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 12/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 10/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.35 |
| ▸ | CFB | P00751 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4979332 | 0.84 | ESR1 (0.40) | ESR1ESR2MAOAMAOB | |
| SCHEMBL8853663 | 0.84 | MAOA (0.39) | ESR1ESR2MAOAMAOB | |
| SCHEMBL10590342 | 0.83 | RAB9A (0.41) | HSD17B10 | |
| SCHEMBL21611100 | 0.80 | KCNH2 (0.38) | — | |
| SCHEMBL9668468 | 0.80 | ESR2 (0.47) | ESR1ESR2MAOAMAOB | |
| SCHEMBL4556498 | 0.75 | SMN1; SMN2 (0.44) | HSD17B10MAOAMAOBCFB | |
| SCHEMBL9863416 | 0.75 | CYP3A4 (0.36) | — | |
| SCHEMBL10339321 | 0.71 | SMN1; SMN2 (0.41) | — | |
| SCHEMBL2477255 | 0.71 | ESR1 (0.74) | ESR1ESR2HSD17B10TTR | |
| SCHEMBL186365 | 0.71 | KCNH2 (0.43) | ESR1ESR2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5002960-A | Viricides for combating picornaviruses | STERLING DRUG, INC. (US) | 1991-03-26 | — | — | US | disclosed |
| US-4985365-A | WITH AN ESTERASE FROM A MICROORGANISM, ASSYMETRIC HYDROLYSIS | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1991-01-15 | — | — | US | disclosed |
| US-4939267-A | Viricides | STERLING DRUG INC. (US) | 1990-07-03 | — | — | US | disclosed |
| US-4843087-A | OXAZOLINYL COMPOUNDS; RHINOVIRUSES AND PICORNAVIRUSES | STERLING DRUG INC. (US) | 1989-06-27 | — | — | US | disclosed |