Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1031248 | 0.98 | TDP1 (0.38) | TDP1ALDH1A1CYP2A6NPC1RAB9A | |
| SCHEMBL15529913 | 0.89 | RAPGEF4 (0.33) | TDP1ALDH1A1CYP2A6NPC1RAB9A | |
| SCHEMBL15529622 | 0.87 | TDP1 (0.39) | TDP1ALDH1A1CYP2A6ACHELMNA | |
| SCHEMBL15529720 | 0.86 | ACHE (0.48) | TDP1ALDH1A1CYP2A6NPC1ACHE | |
| SCHEMBL1028129 | 0.82 | TDP1 (0.46) | TDP1ALDH1A1CYP2A6ACHELMNA | |
| SCHEMBL15529912 | 0.81 | CYP2A6 (0.38) | TDP1ALDH1A1CYP2A6NPC1RAB9A | |
| SCHEMBL15529559 | 0.72 | RAPGEF4 (0.39) | TDP1ALDH1A1CYP2A6LMNATP53 | |
| SCHEMBL1030998 | 0.72 | ACHE (0.53) | TDP1ALDH1A1CYP2A6NPC1RAB9A | |
| SCHEMBL15529624 | 0.72 | CYP1A2 (0.47) | TDP1ALDH1A1CYP2A6NPC1RAB9A | |
| SCHEMBL8501257 | 0.70 | TDP1 (0.44) | TDP1ALDH1A1CYP2A6NPC1RAB9A |
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 |