Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.34 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6707663 | 0.97 | TSHR (0.37) | TSHRMAPK14HDAC3HDAC1HDAC2 | |
| SCHEMBL6707833 | 0.93 | RXFP1 (0.36) | HDAC3HDAC1MAPTTP53POLB | |
| SCHEMBL6710212 | 0.88 | GPR35 (0.35) | CASP3CNR2CCNA2CDK2MAPT | |
| SCHEMBL6710533 | 0.86 | ALDH1A1 (0.34) | CASP3CNR2CCNA2CDK2MAPT | |
| SCHEMBL6711867 | 0.83 | HIF1A (0.37) | LMNAALDH1A1 | |
| SCHEMBL6713762 | 0.83 | GRIK1 (0.38) | TSHRMAPK14HDAC3HDAC1HDAC2 | |
| SCHEMBL6714173 | 0.82 | GRM4 (0.47) | HDAC3HDAC1MAPTTP53LMNA | |
| SCHEMBL6708677 | 0.81 | PKM (0.34) | MAPK14MAPTPARP14THRBLMNA | |
| SCHEMBL6710283 | 0.80 | KDM4E (0.39) | MAPTTP53THRBSMN1; SMN2LMNA | |
| SCHEMBL6708944 | 0.80 | PARP14 (0.39) | TSHRHDAC3HDAC1HDAC2NCOR2 |
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-2004018461-A2 | ANTIBACTERIAL BENZOIC ACID DERIVATIVES | PHARMACIA & UPJOHN COMPANY LLC (US) | 2004-03-04 | — | — | WO | disclosed |