Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.53 |
| ▸ | CES1 | P23141 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.52 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.49 |
| ▸ | GRM5 | P41594 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | GSK3B | P49841 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 3/20 | 0.46 |
| ▸ | RBP4 | P02753 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27433093 | 0.91 | PKM (0.52) | CES2CES1L3MBTL1LMNANAPRT | |
| SCHEMBL29586361 | 0.89 | KMT2A (0.48) | CES2CES1L3MBTL1LMNANAPRT | |
| SCHEMBL23407905 | 0.89 | CES2 (0.46) | CES2CES1L3MBTL1LMNANAPRT | |
| SCHEMBL29771778 | 0.82 | CHRNB2 (0.46) | CES2CES1L3MBTL1LMNANAPRT | |
| SCHEMBL9318374 | 0.80 | CES2 (0.61) | CES2CES1L3MBTL1LMNANAPRT | |
| SCHEMBL29703556 | 0.80 | CES2 (0.61) | CES2CES1L3MBTL1LMNANAPRT | |
| SCHEMBL29235159 | 0.79 | CES2 (0.59) | CES2CES1L3MBTL1LMNANAPRT | |
| SCHEMBL28895231 | 0.79 | CES2 (0.59) | CES2CES1L3MBTL1LMNANAPRT | |
| SCHEMBL30401545 | 0.79 | CES2 (0.59) | CES2CES1L3MBTL1LMNANAPRT | |
| SCHEMBL1698149 | 0.79 | CES2 (0.59) | CES2CES1L3MBTL1LMNANAPRT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104870422-B | Amine derivative or its salt | 富士胶片富山化学株式会社 | 2019-03-15 | — | — | CN | disclosed |
| CN-104870422-A | Novel amine derivative or salt thereof | TOYAMA CHEMICAL CO LTD | 2015-08-26 | — | — | CN | disclosed |
| CN-101346377-A | Aryl-isoxazol-4-yl-imidazoy1, 5-A pyridine derivatives | HOFFMANN LA ROCHE (CH) | 2009-01-14 | — | — | CN | disclosed |