Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | G6PD | P11413 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15529922 | 0.87 | TDP1 (0.37) | TDP1ALDH1A1ACHECYP1A2CYP2A6 | |
| SCHEMBL1028129 | 0.85 | TDP1 (0.46) | TDP1ALDH1A1ACHECYP1A2CYP2A6 | |
| SCHEMBL1031248 | 0.84 | TDP1 (0.38) | TDP1ALDH1A1ACHECYP1A2CYP2A6 | |
| SCHEMBL15529720 | 0.81 | ACHE (0.48) | TDP1ALDH1A1ACHECYP1A2CYP2A6 | |
| SCHEMBL15529913 | 0.78 | RAPGEF4 (0.33) | TDP1ALDH1A1CYP1A2CYP2A6TP53 | |
| SCHEMBL15529912 | 0.76 | CYP2A6 (0.38) | TDP1ALDH1A1ACHECYP1A2CYP2A6 | |
| SCHEMBL15529559 | 0.76 | RAPGEF4 (0.39) | TDP1ALDH1A1CYP1A2CYP2A6TP53 | |
| SCHEMBL1030106 | 0.74 | ACHE (0.57) | TDP1ALDH1A1ACHECYP1A2CYP2A6 | |
| SCHEMBL8501257 | 0.73 | TDP1 (0.44) | TDP1ALDH1A1ACHECYP1A2CYP2A6 | |
| SCHEMBL1030327 | 0.71 | TDP1 (0.42) | TDP1ALDH1A1ACHECYP1A2CYP2A6 |
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-2013167585-A2 | RECYCLING OF ORGANOTIN COMPOUNDS | UNIVERSITEIT ANTWERPEN (BE) | 2013-11-14 | — | — | WO | disclosed |