Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | VCAM1 | P19320 | 6/20 | 0.47 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | MERTK | Q12866 | 2/20 | 0.42 |
| ▸ | PGK1 | P00558 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL359519 | 0.87 | TSHR (0.60) | TSHRMAPK1ALDH1A1CYP3A4VCAM1 | |
| SCHEMBL9180125 | 0.85 | TSHR (0.62) | TSHRMAPK1ALDH1A1CYP3A4VCAM1 | |
| SCHEMBL9732540 | 0.82 | MAPK1 (0.52) | TSHRMAPK1ALDH1A1CYP3A4VCAM1 | |
| Hydrazine SCHEMBL28169379 | 0.80 | TSHR (0.44) | TSHRMAPK1ALDH1A1CYP3A4VCAM1 | |
| SCHEMBL1626066 | 0.80 | TSHR (0.58) | TSHRMAPK1ALDH1A1CYP3A4VCAM1 | |
| SCHEMBL30953145 | 0.80 | TSHR (0.58) | TSHRMAPK1ALDH1A1CYP3A4VCAM1 | |
| SCHEMBL838256 | 0.79 | ALDH1A1 (0.71) | TSHRMAPK1ALDH1A1CYP3A4VCAM1 | |
| SCHEMBL8767757 | 0.77 | ALDH1A1 (0.63) | TSHRMAPK1ALDH1A1CYP3A4VCAM1 | |
| SCHEMBL11548194 | 0.77 | ALDH1A1 (0.63) | TSHRMAPK1ALDH1A1CYP3A4VCAM1 | |
| SCHEMBL8967138 | 0.77 | TDP1 (0.50) | TSHRMAPK1ALDH1A1CYP3A4VCAM1 |
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-1727781-B1 | PROCESS FOR THE PREPARATION OF HIGH QUALITY 3,3',4,4'-TETRAMINOBIPHENYL | COUNCIL SCIENT IND RES (IN) | 2009-05-06 | — | — | EP | disclosed |