Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | CDA | P32320 | 1/20 | 0.49 |
| ▸ | ADK | P55263 | 1/20 | 0.47 |
| ▸ | DOT1L | Q8TEK3 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MTOR | P42345 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | BLM | P54132 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.46 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.46 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.46 |
| ▸ | GMNN | O75496 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | HBB | P68871 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9697804 | 1.00 | MAPT (0.49) | MAPTCDAADKDOT1LALDH1A1 | |
| SCHEMBL15670883 | 0.78 | LMNA (0.56) | MAPTCDADOT1LALDH1A1LMNA | |
| SCHEMBL3851144 | 0.78 | LMNA (0.56) | MAPTCDADOT1LALDH1A1LMNA | |
| SCHEMBL1520633 | 0.78 | MAPT (0.52) | MAPTCDADOT1LALDH1A1LMNA | |
| SCHEMBL30495894 | 0.73 | SMN1; SMN2 (0.51) | MAPTCDAADKDOT1LALDH1A1 | |
| SCHEMBL4854235 | 0.73 | MAPT (0.50) | MAPTCDADOT1LALDH1A1LMNA | |
| SCHEMBL18986084 | 0.73 | MAPT (0.50) | MAPTCDADOT1LALDH1A1LMNA | |
| SCHEMBL30411899 | 0.72 | SMN1; SMN2 (0.50) | MAPTCDAADKDOT1LALDH1A1 | |
| SCHEMBL9698994 | 0.71 | ALDH1A1 (0.47) | MAPTCDAADKDOT1LALDH1A1 | |
| SCHEMBL13065920 | 0.71 | SMN1; SMN2 (0.56) | MAPTCDAALDH1A1LMNAMTOR |
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-3122353-A1 | SUBSTITUTED INDOLE MCL-1 INHIBITORS | Vanderbilt University (US) | 2017-02-01 | — | — | EP | disclosed |
| WO-2015148854-A1 | SUBSTITUTED INDOLE MCL-1 INHIBITORS | VANDERBILT UNIVERSITY (US) | 2015-10-01 | — | — | WO | disclosed |