Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ANPEP | P15144 | 1/20 | 0.38 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.38 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.38 |
| ▸ | PTGIR | P43119 | 1/20 | 0.38 |
| ▸ | ECE1 | P42892 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19963100 | 1.00 | LMNA (0.43) | LMNAGAATSHRTBXAS1KDM4E | |
| SCHEMBL19963222 | 0.89 | CYP1A2 (0.46) | ANPEPERAP2ERAP1CYP1A2TRPV1 | |
| SCHEMBL21986104 | 0.82 | MME (0.39) | ANPEPERAP2ERAP1CYP1A2TRPV1 | |
| SCHEMBL19963024 | 0.81 | ESR1 (0.42) | KMT2ATDP1CYP1A2 | |
| SCHEMBL21985995 | 0.81 | POLB (0.39) | CYP1A2TRPV1 | |
| SCHEMBL19963171 | 0.81 | NPC1 (0.38) | PTGIRCYP1A2TRPV1 | |
| SCHEMBL19963028 | 0.81 | MME (0.42) | KMT2ACYP1A2TRPV1 | |
| SCHEMBL29594970 | 0.79 | CYP3A4 (0.40) | LMNAGAATBXAS1KDM4EHTT | |
| SCHEMBL19963087 | 0.79 | CYP3A4 (0.40) | LMNAGAATBXAS1KDM4EHTT | |
| SCHEMBL20544347 | 0.78 | PTGES (0.39) | CYP1A2 |
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-108699013-B | Spiroquinone derivative, method for preparing the same, and pharmaceutical composition for preventing or treating neurological disorders containing the same as an active ingredient | 嘉泉大学校校产学协力团 | 2022-05-06 | — | — | CN | disclosed |