Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 6/20 | 0.42 |
| ▸ | SPHK2 | Q9NRA0 | 4/20 | 0.40 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL4995897 | 0.80 | SPHK2 (0.42) | ESR1MEN1KMT2ALMNAHTT | |
| SCHEMBL649556 | 0.74 | ESR1 (0.60) | ESR1MEN1KMT2ALMNAHTT | |
| SCHEMBL16364512 | 0.74 | ESR1 (0.60) | ESR1MEN1KMT2ALMNAHTT | |
| SCHEMBL28789384 | 0.73 | ESR1 (0.58) | ESR1MEN1KMT2ALMNAHTT | |
| SCHEMBL17370938 | 0.70 | MEN1 (0.58) | ESR1MEN1KMT2ALMNAHTT | |
| SCHEMBL3848262 | 0.70 | ESR1 (0.52) | ESR1MEN1KMT2ALMNAHTT | |
| SCHEMBL1548582 | 0.69 | MEN1 (0.57) | ESR1MEN1KMT2ALMNAHTT | |
| SCHEMBL19150636 | 0.69 | GRIN2D (0.62) | ESR1MEN1KMT2ALMNAPGR | |
| SCHEMBL1548747 | 0.68 | LMNA (0.61) | MEN1KMT2ALMNAHTTSMN1; SMN2 | |
| SCHEMBL1548365 | 0.68 | SPHK2 (0.57) | MEN1KMT2ALMNAHTTSMN1; SMN2 |
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-8063248-B2 | 3-(4-Chloro-phenyl)-adamantane-1-carboxylic acidisopropylamide; antiproliferative, antiinflammatory agent, angiogenesis inhibitor; sphingolipid-derived signaling pathway; coupling acid or acylhalide of phenyl-adamantane derivatives with aminoalkyl-pyridine | APOGEE BIOTECHNOLOGY CORPORATION (US) | 2011-11-22 | — | — | US | claimed |