Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | CA5A | P35218 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 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 | |
|---|---|---|---|---|
| SCHEMBL2986904 | 0.86 | TSHR (0.54) | TSHRCYP19A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL30047158 | 0.86 | TSHR (0.54) | TSHRCYP19A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4432418 | 0.84 | CYP1A2 (0.56) | TSHRCYP19A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL2999354 | 0.83 | TSHR (0.59) | TSHRCYP19A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1169876 | 0.83 | TSHR (0.59) | TSHRCYP19A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1937924 | 0.83 | CYP19A1 (0.58) | TSHRCYP19A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7131786 | 0.83 | TSHR (0.62) | TSHRCYP19A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4430317 | 0.82 | CYP1A2 (0.56) | TSHRCYP19A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4424906 | 0.82 | CYP2C19 (0.50) | TSHRCYP19A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4426596 | 0.82 | KMT2A (0.51) | TSHRCYP19A1CYP1A2CYP3A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1845083-A2 | New arylsulfonohydrazide inhibitors of enzymes MurC and MurD | UNIVERZA V LJUBLJANI, FAKULTETA ZA FARMACIJO (SI) | 2007-10-17 | — | — | EP | disclosed |