Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.39 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 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 | |
|---|---|---|---|---|
| SCHEMBL9843277 | 1.00 | ESR1 (0.39) | ESR1ESR2PDCD1CD274ALOX15 | |
| SCHEMBL6236758 | 0.75 | MAPT (0.35) | TDP1LMNAMAPTKDM4EMEN1 | |
| SCHEMBL6235956 | 0.75 | — | — | |
| SCHEMBL9843274 | 0.75 | PREP (0.42) | ESR1ESR2PDCD1CD274ALOX15 | |
| SCHEMBL9841988 | 0.75 | PREP (0.42) | ESR1ESR2PDCD1CD274ALOX15 | |
| SCHEMBL9697307 | 0.74 | LMNA (0.39) | PTGS1LMNACYP2D6TSHRKDM4E | |
| SCHEMBL5854288 | 0.72 | LTA4H (0.45) | ESR1ESR2TDP1PTGS1SLC6A2 | |
| SCHEMBL20980713 | 0.70 | ESR2 (0.64) | ESR1ESR2PDCD1CD274TDP1 | |
| SCHEMBL8975027 | 0.70 | ESR2 (0.64) | ESR1ESR2PDCD1CD274TDP1 | |
| SCHEMBL14078120 | 0.70 | ESR1 (0.39) | ESR1ESR2PDCD1CD274ALOX15 |
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-5041516-A | Macromolecules | CORNELL RESEARCH FOUNDATION, INC. (US) | 1991-08-20 | — | — | US | disclosed |