Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 17/20 | 0.72 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7986331 | 0.95 | F2 (0.79) | F2ESR1ESR2 | |
| SCHEMBL7986323 | 0.95 | F2 (0.79) | F2ESR1ESR2 | |
| Trifluoroacetic Acid SCHEMBL7987477 | 0.91 | F2 (0.74) | F2ESR1ESR2OPRM1OPRD1 | |
| SCHEMBL7990346 | 0.90 | F2 (0.77) | F2ESR1ESR2 | |
| SCHEMBL7990352 | 0.90 | F2 (0.77) | F2ESR1ESR2 | |
| SCHEMBL7993588 | 0.87 | F2 (0.72) | F2ESR1ESR2 | |
| SCHEMBL7993596 | 0.87 | F2 (0.72) | F2ESR1ESR2 | |
| SCHEMBL6597667 | 0.86 | F2 (0.81) | F2ESR1ESR2 | |
| SCHEMBL6597655 | 0.86 | F2 (0.81) | F2ESR1ESR2 | |
| SCHEMBL7989747 | 0.86 | F2 (0.81) | F2ESR1ESR2 |
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-6288105-B1 | COMPOUNDS SUCH AS (S)-2-(4-((2-AMINO-3-HYDROXY-1-OXOPROPYL)AMINO)PHENYL)-6-HYDRO XY-3-(3-METHOXY-4-(1-PYRROLIDINYLMETHYL)BENZYL)BENZO(B)THIOPHE NE | ELI LILLY AND COMPANY | 2001-09-11 | — | — | US | disclosed |