Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | EGFR | P00533 | 4/20 | 0.51 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.40 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28558501 | 1.00 | LMNA (0.54) | LMNAALDH1A1EGFRCREBBPPTGDR2 | |
| SCHEMBL29062859 | 0.90 | LMNA (0.60) | LMNAALDH1A1EGFRCREBBPBRD4 | |
| SCHEMBL31379038 | 0.90 | LMNA (0.60) | LMNAALDH1A1EGFRCREBBPBRD4 | |
| SCHEMBL11284893 | 0.82 | LMNA (0.48) | LMNAALDH1A1CREBBPBRD4 | |
| SCHEMBL9766028 | 0.81 | ALDH1A1 (0.60) | LMNAALDH1A1EGFRCREBBPBRD4 | |
| SCHEMBL9153385 | 0.80 | LMNA (0.54) | LMNAALDH1A1EGFRCREBBPBRD4 | |
| SCHEMBL29062879 | 0.77 | LMNA (0.58) | LMNAALDH1A1EGFRCREBBP | |
| SCHEMBL9153145 | 0.77 | LMNA (0.51) | LMNAALDH1A1CREBBPBRD4 | |
| SCHEMBL9766033 | 0.77 | LMNA (0.51) | LMNAALDH1A1CREBBPBRD4 | |
| SCHEMBL24885111 | 0.76 | ABL1 (0.47) | LMNAHDAC6TDP1 |
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-112679426-B | Intermediate compound for synthesizing nitrogen-containing heterocycle and preparation method and application thereof | 上海交通大学 | 2022-09-30 | — | — | CN | disclosed |