Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KIF11 | P52732 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 4/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | PYGL | P06737 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.43 |
| ▸ | IDH1 | O75874 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL23769072 | 1.00 | TRPV1 (0.49) | TRPV1CYP3A4CYP19A1CYP2C9ALDH1A1 | |
| SCHEMBL14073923 | 0.88 | CYP3A4 (0.54) | TRPV1CYP3A4CYP19A1CYP2C9ALDH1A1 | |
| SCHEMBL14073760 | 0.82 | MAOA (0.56) | TRPV1CYP3A4CYP19A1CYP2C9ALDH1A1 | |
| SCHEMBL22803724 | 0.79 | ESR1 (0.63) | ALDH1A1MAPTESR1MAOAPYGL | |
| SCHEMBL14073640 | 0.79 | ALDH1A1 (0.61) | TRPV1ALDH1A1MAPTESR1KMT2A | |
| SCHEMBL31668714 | 0.78 | ESR1 (0.61) | ALDH1A1MAPTESR1MAOAPYGL | |
| SCHEMBL14073821 | 0.77 | KMT2A (0.55) | TRPV1CYP3A4CYP19A1CYP2C9ALDH1A1 | |
| SCHEMBL4578101 | 0.76 | TRPV1 (0.56) | TRPV1CYP3A4CYP19A1CYP2C9ALDH1A1 | |
| SCHEMBL23769049 | 0.76 | P2RX4 (0.45) | MAPTESR1MAOAPYGLCFTR | |
| SCHEMBL29979030 | 0.76 | P2RX4 (0.45) | MAPTESR1MAOAPYGLCFTR |
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 |
|---|---|---|---|---|---|---|---|
| CN-115151304-A | Small molecule interferon gene stimulating factor (STING) antagonists | 库拉德夫制药私人有限公司 | 2022-10-04 | — | — | CN | claimed |