Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.56 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.56 |
| ▸ | CREBBP | Q92793 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | MITF | O75030 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28404799 | 0.87 | TAS1R3 (0.54) | TAS1R3TAS1R1CREBBPTSHRSMN1; SMN2 | |
| SCHEMBL13753812 | 0.85 | TAS1R3 (0.61) | TAS1R3TAS1R1LMNATSHRSMN1; SMN2 | |
| SCHEMBL5340855 | 0.83 | TSHR (0.68) | CREBBPLMNATSHRSMN1; SMN2NPC1 | |
| SCHEMBL13753814 | 0.81 | TP53 (0.67) | TAS1R3TAS1R1LMNATSHRMAPT | |
| SCHEMBL641868 | 0.80 | CREBBP (0.64) | CREBBPLMNATSHRHSD17B10HDAC1 | |
| SCHEMBL5334076 | 0.78 | LMNA (0.54) | CREBBPLMNATSHRSMN1; SMN2NPC1 | |
| SCHEMBL17395803 | 0.78 | CREBBP (0.76) | CREBBPSMN1; SMN2NPC1MITFRAB9A | |
| SCHEMBL21887388 | 0.77 | LMNA (0.68) | CREBBPLMNATSHRSMN1; SMN2NPC1 | |
| SCHEMBL3174029 | 0.77 | LMNA (0.56) | CREBBPLMNATSHRSMN1; SMN2NPC1 | |
| SCHEMBL29793644 | 0.77 | LMNA (0.52) | CREBBPLMNATSHRSMN1; SMN2NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108929263-B | Arylamide Kv2.1 inhibitor and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2022-07-22 | — | — | CN | disclosed |
| CN-111108092-A | Arylamide Kv2.1 inhibitor and preparation method, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2020-05-05 | — | — | CN | disclosed |