Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 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 | |
|---|---|---|---|---|
| SCHEMBL17677417 | 0.80 | ALDH1A1 (0.48) | ALDH1A1TDP1TSHRHDAC8TAS1R3 | |
| SCHEMBL8767173 | 0.78 | ALDH1A1 (0.41) | ALDH1A1TDP1TSHRTAS1R3TAS1R1 | |
| SCHEMBL29030380 | 0.76 | ALDH1A1 (0.48) | ALDH1A1TDP1TSHRTAS1R3TAS1R1 | |
| SCHEMBL14551185 | 0.75 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRTAS1R3TAS1R1 | |
| SCHEMBL17449655 | 0.75 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRHDAC8TAS1R3 | |
| SCHEMBL12258226 | 0.75 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRHDAC8TAS1R3 | |
| SCHEMBL14551186 | 0.75 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRTAS1R3TAS1R1 | |
| SCHEMBL718000 | 0.74 | ALDH1A1 (0.41) | ALDH1A1TDP1TSHRHDAC8TAS1R3 | |
| SCHEMBL13826229 | 0.73 | ALDH1A1 (0.58) | ALDH1A1TDP1TSHRHDAC8TAS1R3 | |
| SCHEMBL29257290 | 0.72 | ALDH1A1 (0.73) | ALDH1A1TDP1TSHRHDAC8TAS1R3 |
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 |
|---|---|---|---|---|---|---|---|
| US-20160017103-A1 | CNT-POLYMER COMPLEX CAPABLE OF SELF-DOPING BY EXTERNAL STIMULI AND PROCESS FOR PREPARING THE SAME | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2016-01-21 | — | — | US | disclosed |