Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | RXRA | P19793 | 3/20 | 0.39 |
| ▸ | RXRB | P28702 | 3/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.39 |
| ▸ | RXRG | P48443 | 1/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | ALPG | P10696 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2335804 | 0.81 | ANPEP (0.45) | ESR1ESR2ALDH1A1SMN1; SMN2RXRA | |
| SCHEMBL7302128 | 0.78 | TSHR (0.48) | TSHRTP53KMT2AALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9695884 | 0.77 | TSHR (0.46) | TSHRTP53KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL5124953 | 0.75 | TSHR (0.55) | TSHRTP53KMT2AALDH1A1SMN1; SMN2 | |
| Terephthalic Acid SCHEMBL9017249 | 0.74 | TSHR (0.67) | TSHRTP53KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL15543858 | 0.72 | TSHR (0.50) | TSHRTP53KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL28932021 | 0.71 | MAPT (0.47) | ESR1ESR2TSHRTP53KMT2A | |
| SCHEMBL31192242 | 0.71 | TSHR (0.60) | TSHRTP53KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL8154043 | 0.71 | TSHR (0.60) | TSHRTP53ALDH1A1SMN1; SMN2ALOX15 | |
| SCHEMBL105270 | 0.71 | RXRA (0.62) | TSHRTP53KMT2AALDH1A1SMN1; SMN2 |
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-2358689-A1 | Benzothiazole derivatives as anticancer agents | Takeda Pharmaceutical Company Limited (JP) | 2011-08-24 | — | — | EP | disclosed |
| WO-2010064722-A1 | BENZOTHIAZOLE DERIVATIVES AS ANTICANCER AGENTS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-06-10 | — | — | WO | disclosed |