Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.41 |
| ▸ | POR | P16435 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | PTPRC | P08575 | 1/20 | 0.31 |
| ▸ | TDP2 | O95551 | 1/20 | 0.30 |
| ▸ | NSD2 | O96028 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.30 |
| ▸ | RET | P07949 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23567051 | 0.86 | NPC1 (0.43) | NQO1PORCHRM2CHRM4CHRM5 | |
| SCHEMBL28218475 | 0.73 | KDM4E (0.50) | NQO1PORLMNAPTPRC | |
| SCHEMBL23567451 | 0.72 | ACHE (0.43) | NQO1PORCHRM2CHRM4CHRM5 | |
| SCHEMBL26316129 | 0.71 | ACHE (0.47) | NQO1PORADRA1DADRA1AADRA1B | |
| SCHEMBL23567062 | 0.69 | ADRA1D (0.50) | ADRA1DADRA1AADRA1BHSP90AA1 | |
| SCHEMBL23566250 | 0.69 | ALDH1A1 (0.47) | ADRA1DADRA1AADRA1B | |
| SCHEMBL10166445 | 0.68 | CHRM2 (0.38) | NQO1PORCHRM2CHRM4CHRM5 | |
| SCHEMBL11983822 | 0.68 | CHRM2 (0.38) | NQO1PORCHRM2CHRM4CHRM5 | |
| SCHEMBL23566743 | 0.68 | ACHE (0.38) | NQO1PORCHRM2CHRM4CHRM5 | |
| SCHEMBL23567431 | 0.68 | HSD11B1 (0.46) | ADRA1DADRA1AADRA1B |
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-2011031628-A1 | INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE | SCHERING CORPORATION (US) | 2011-03-17 | — | — | WO | disclosed |