Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | TCF7L2 | Q9NQB0 | 1/20 | 0.41 |
| ▸ | PTGFR | P43088 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.39 |
| ▸ | CDK7 | P50613 | 1/20 | 0.39 |
| ▸ | CCNH | P51946 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4144435 | 0.96 | BACE1 (0.45) | BACE1HDAC1MAPTRXFP1THRB | |
| SCHEMBL4150494 | 0.93 | BACE1 (0.45) | BACE1HDAC1MAPTRXFP1THRB | |
| SCHEMBL4441319 | 0.93 | BACE1 (0.46) | BACE1HDAC1MAPTRXFP1THRB | |
| SCHEMBL4137733 | 0.92 | BACE1 (0.47) | BACE1HDAC1MAPTRXFP1THRB | |
| SCHEMBL4443840 | 0.90 | BACE1 (0.45) | BACE1HDAC1MAPTRXFP1THRB | |
| SCHEMBL4135635 | 0.90 | BACE1 (0.49) | BACE1HDAC1MAPTRXFP1THRB | |
| SCHEMBL4142723 | 0.90 | BACE1 (0.43) | BACE1HDAC1MAPTRXFP1THRB | |
| SCHEMBL4129999 | 0.88 | HDAC1 (0.48) | BACE1HDAC1MAPTRXFP1THRB | |
| SCHEMBL4438905 | 0.87 | BACE1 (0.45) | BACE1MAPTRXFP1THRBLMNA | |
| SCHEMBL4137652 | 0.86 | ABL1 (0.46) | BACE1HDAC1MAPTRXFP1THRB |
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-2134695-A1 | INHIBITORS OF THE HEDGEHOG PATHWAY | Exelixis, Inc. (US) | 2009-12-23 | — | — | EP | disclosed |
| WO-2008112913-A1 | INHIBITORS OF THE HEDGEHOG PATHWAY | EXELIXIS, INC. (US) | 2008-09-18 | — | — | WO | disclosed |