Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4413629 | 0.82 | ESR1 (0.45) | ESR1ESR2KDM4EALDH1A1ALOX12 | |
| SCHEMBL910279 | 0.69 | — | — | |
| SCHEMBL658128 | 0.65 | ESR1 (0.38) | ESR1ESR2 | |
| SCHEMBL6053151 | 0.65 | ESR1 (0.42) | ESR1ESR2ALDH1A1 | |
| SCHEMBL635664 | 0.65 | ESR1 (0.38) | ESR1ESR2 | |
| SCHEMBL1935108 | 0.65 | ESR1 (0.42) | ESR1ESR2ALDH1A1 | |
| SCHEMBL4096134 | 0.65 | ESR1 (0.38) | ESR1ESR2 | |
| SCHEMBL19222745 | 0.65 | ESR1 (0.38) | ESR1ESR2 | |
| SCHEMBL21085897 | 0.65 | ESR1 (0.38) | ESR1ESR2 | |
| SCHEMBL540773 | 0.65 | ESR1 (0.38) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2117315-A1 | ADAMANTANAMINES AND NERAMEXANE SALTS OF THIOMOLYBDIC AND THIOTUNGSTIC ACIDS | SSV Therapeutics, Inc. (US) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008103421-A1 | ADAMANTANAMINES AND NERAMEXANE SALTS OF THIOMOLYBDIC AND THIOTUNGSTIC ACIDS | SSV THERAPEUTICS, INC. (US) | 2008-08-28 | — | — | WO | disclosed |