Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 2/20 | 0.30 |
| ▸ | MAOB | P27338 | 2/20 | 0.30 |
| ▸ | BCHE | P06276 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | APEX1 | P27695 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL48973 | 0.70 | TDP1 (0.42) | ERBB2TDP1ALDH1A1RECQLMEN1 | |
| SCHEMBL16947211 | 0.69 | ALDH1A1 (0.40) | ERBB2TDP1ALDH1A1RECQLMEN1 | |
| SCHEMBL5959263 | 0.69 | MAPT (0.40) | ERBB2TDP1ALDH1A1RECQLMEN1 | |
| SCHEMBL9115531 | 0.65 | SNCA (0.44) | TDP1ALDH1A1RECQLMEN1MAPT | |
| SCHEMBL9115527 | 0.65 | SNCA (0.44) | TDP1ALDH1A1RECQLMEN1MAPT | |
| SCHEMBL2365220 | 0.65 | MAPT (0.37) | ERBB2TDP1ALDH1A1RECQLMEN1 | |
| SCHEMBL8627021 | 0.65 | ERBB2 (0.38) | ERBB2TDP1ALDH1A1RECQLMEN1 | |
| SCHEMBL18235958 | 0.61 | ERBB2 (0.34) | ERBB2TDP1ALDH1A1RECQLMEN1 | |
| SCHEMBL221723 | 0.59 | — | — | |
| SCHEMBL28134388 | 0.59 | MAPT (0.46) | ERBB2TDP1ALDH1A1RECQLMEN1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101088999-A | Process of synthesizing 3-amino quinine dihydrochloride | UNIV WUHAN TECH (CN) | 2007-12-19 | — | — | CN | claimed |
| CN-116789971-A | Preparation method and application of normal-temperature self-healing antifouling resin containing double antifouling factors | 浙江省海洋开发研究院 | 2023-09-22 | — | — | CN | disclosed |
| CN-101970438-A | Novel 1, 4-diaza-bicyclo [3.2.2] nonyl pyrimidine derivatives and their medical use | NEUROSEARCH AS | 2011-02-09 | — | — | CN | disclosed |
| CN-101855223-A | Novel 1,4-diaza-bicyclo[3.2.2]nonyl pyrimidine derivatives and their medical use | NEUROSEARCH AS | 2010-10-06 | — | — | CN | disclosed |
| CN-101088999-A | Process of synthesizing 3-amino quinine dihydrochloride | UNIV WUHAN TECH (CN) | 2007-12-19 | — | — | CN | disclosed |