Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | CES2 | O00748 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | DAO | P14920 | 1/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | SNCA | P37840 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | F2 | P00734 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | BLM | P54132 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA4 | P22748 | 2/20 | 0.45 |
| ▸ | F10 | P00742 | 1/20 | 0.45 |
| ▸ | F12 | P00748 | 1/20 | 0.45 |
| ▸ | F7 | P08709 | 1/20 | 0.45 |
| ▸ | F3 | P13726 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL67982 | 0.96 | CES1 (0.53) | CES1CES2TSHRDAONAPRT | |
| Benzene SCHEMBL28326432 | 0.96 | CES1 (0.53) | CES1CES2TSHRDAONAPRT | |
| SCHEMBL28901985 | 0.92 | CES1 (0.50) | CES1CES2TSHRDAONAPRT | |
| SCHEMBL5498483 | 0.92 | CES1 (0.50) | CES1CES2TSHRDAONAPRT | |
| Ammonia Solution, Strong SCHEMBL28027299 | 0.92 | CES1 (0.50) | CES1CES2TSHRDAONAPRT | |
| SCHEMBL28643562 | 0.92 | CES1 (0.50) | CES1CES2TSHRDAONAPRT | |
| SCHEMBL9580190 | 0.92 | CES1 (0.50) | CES1CES2TSHRDAONAPRT | |
| SCHEMBL28445093 | 0.92 | CES1 (0.50) | CES1CES2TSHRDAONAPRT | |
| SCHEMBL27970663 | 0.92 | CES1 (0.50) | CES1CES2TSHRDAONAPRT | |
| Bromide SCHEMBL26697305 | 0.92 | CES1 (0.50) | CES1CES2TSHRDAONAPRT |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114805827-B | Ionic organic framework structure material and preparation method and application thereof | 华南理工大学 | 2023-01-06 | — | — | CN | claimed |
| CN-114805827-A | Ionic organic framework structure material and preparation method and application thereof | 华南理工大学 | 2022-07-29 | — | — | CN | claimed |
| CN-114805827-B | Ionic organic framework structure material and preparation method and application thereof | 华南理工大学 | 2023-01-06 | — | — | CN | disclosed |
| CN-114805827-B | Ionic organic framework structure material and preparation method and application thereof | 华南理工大学 | 2023-01-06 | — | — | CN | disclosed |
| CN-114805827-A | Ionic organic framework structure material and preparation method and application thereof | 华南理工大学 | 2022-07-29 | — | — | CN | disclosed |
| CN-114805827-A | Ionic organic framework structure material and preparation method and application thereof | 华南理工大学 | 2022-07-29 | — | — | CN | disclosed |