Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HMGCR | P04035 | 3/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.32 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 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 | |
|---|---|---|---|---|
| SCHEMBL13670084 | 0.80 | BRD4 (0.45) | BRD4KCNH2POLBHMGCRTLR8 | |
| Ammonia Solution, Strong SCHEMBL27432333 | 0.76 | BRD4 (0.47) | BRD4KCNH2ALDH1A1CALM1MBOAT4 | |
| SCHEMBL955189 | 0.73 | BRD4 (0.45) | BRD4KCNH2POLBHMGCRTLR8 | |
| SCHEMBL13670533 | 0.73 | MAPT (0.32) | POLBALDH1A1 | |
| SCHEMBL11330543 | 0.72 | KCNH2 (0.62) | BRD4KCNH2POLBALDH1A1CALM1 | |
| SCHEMBL13670534 | 0.72 | LOXL2 (0.41) | HPGDALDH1A1 | |
| SCHEMBL956811 | 0.71 | BRD4 (0.43) | BRD4KCNH2POLBHMGCRTSHR | |
| SCHEMBL3407693 | 0.70 | BRD4 (0.42) | BRD4KCNH2POLBHMGCRTSHR | |
| SCHEMBL13670530 | 0.70 | ADRA2A (0.40) | HPGDALDH1A1 | |
| SCHEMBL13568670 | 0.70 | ADRB1 (0.37) | TSHRHPGDALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009118087-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2009-10-01 | — | — | WO | disclosed |