Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | VNN1 | O95497 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 2/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL23784226 | 0.81 | TDP1 (0.51) | L3MBTL1TDP1VNN1ATMCES2 | |
| SCHEMBL18973404 | 0.81 | VNN1 (0.57) | L3MBTL1TDP1VNN1ATMCES2 | |
| SCHEMBL8619264 | 0.81 | CES1 (0.64) | L3MBTL1TDP1CES2CES1AKR1B1 | |
| SCHEMBL10962854 | 0.81 | VNN1 (0.56) | L3MBTL1TDP1VNN1ATMCES2 | |
| SCHEMBL5880689 | 0.80 | CES1 (0.52) | L3MBTL1TDP1ATMTAAR1CES2 | |
| SCHEMBL30120603 | 0.80 | NAPRT (0.56) | KMT2AALDH1A1EPHX2LMNA | |
| SCHEMBL16198319 | 0.80 | NAPRT (0.56) | KMT2AALDH1A1EPHX2LMNA | |
| Hydrochloric Acid SCHEMBL31358963 | 0.79 | NAPRT (0.54) | ALDH1A1EPHX2LMNA | |
| Hydrochloric Acid SCHEMBL31358964 | 0.79 | NAPRT (0.54) | ALDH1A1EPHX2LMNA | |
| Hydrochloric Acid SCHEMBL23855082 | 0.79 | NAPRT (0.54) | ALDH1A1EPHX2LMNA |
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-109796352-B | Ortho-alkylated arylamine and preparation method thereof | 广东工业大学 | 2022-02-15 | — | — | CN | disclosed |
| CN-109796352-A | A kind of ortho-alkylating arylamine and preparation method thereof | 广东工业大学 | 2019-05-24 | — | — | CN | disclosed |