Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | DBH | P09172 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | MPO | P05164 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | DNTT | P04053 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | THRA | P10827 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL8812580 | 0.90 | TNF (0.37) | HTR6POLBMPOPARP1 | |
| SCHEMBL8685833 | 0.90 | HTR6 (0.43) | CHRNB2CHRNA7CHRNA4HTR6ALDH1A1 | |
| SCHEMBL8814121 | 0.89 | PARP1 (0.41) | HTR6CYP1A2CYP3A4TSHRMPO | |
| SCHEMBL8811933 | 0.89 | HTR6 (0.41) | HTR6MPOPARP1 | |
| SCHEMBL8810754 | 0.89 | PARP1 (0.41) | HTR6ALDH1A1POLBCYP3A4MPO | |
| SCHEMBL8811969 | 0.89 | RHEB (0.40) | HTR6MPOGAA | |
| SCHEMBL8810209 | 0.87 | CYP19A1 (0.40) | POLBAPP | |
| SCHEMBL8810917 | 0.87 | CHRNB2 (0.41) | CHRNB2CHRNA7CHRNA4HTR6POLB | |
| SCHEMBL8813445 | 0.87 | HTR6 (0.40) | HTR6ALDH1A1CYP1A2CYP3A4MPO | |
| Dimethylamine SCHEMBL8812830 | 0.86 | HTR6 (0.43) | CHRNB2CHRNA7CHRNA4HTR6CYP1A2 |
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-0780389-A1 | Thiazolidinedione derivatives, process for their preparation and pharmaceutical compositions containing them | TOBISHI PHARMACEUTICAL CO., LTD. (JP) | 1997-06-25 | — | — | EP | disclosed |