Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MIF | P14174 | 6/20 | 0.72 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.70 |
| ▸ | MAOB | P27338 | 3/20 | 0.65 |
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | RAB9A | P51151 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | HPGD | P15428 | 1/20 | 0.62 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 4/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.57 |
| ▸ | GLA | P06280 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.57 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.57 |
| ▸ | MAOA | P21397 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL3366496 | 0.88 | POLB (0.71) | MIFMAOBNPC1ALDH1A1HPGD | |
| SCHEMBL93300 | 0.86 | MAOB (0.85) | MAOBSLC16A3MAOA | |
| SCHEMBL2910106 | 0.84 | SLC16A3 (0.64) | MIFPFKFB3MAOBALDH1A1HPGD | |
| SCHEMBL29399552 | 0.83 | MIF (1.00) | MIFPFKFB3MAOBALDH1A1HPGD | |
| SCHEMBL1406240 | 0.83 | MIF (1.00) | MIFPFKFB3MAOBALDH1A1HPGD | |
| SCHEMBL30267263 | 0.81 | MIF (0.90) | MIFPFKFB3MAOBALDH1A1HPGD | |
| SCHEMBL27952014 | 0.80 | MEN1 (0.62) | MIFMAOBALDH1A1MEN1KMT2A | |
| SCHEMBL10855650 | 0.79 | MIF (0.77) | MIFPFKFB3MAOBALDH1A1HPGD | |
| SCHEMBL22148003 | 0.79 | MAOB (1.00) | MIFPFKFB3MAOBRAB9AALDH1A1 | |
| SCHEMBL103400 | 0.78 | MIF (0.72) | MIFPFKFB3MAOBALDH1A1HPGD |
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-109706133-B | Novel esterase and application thereof | 上海交通大学 | 2022-12-27 | — | — | CN | disclosed |
| CN-109706133-A | One group of novel esterases and its application | 上海交通大学 | 2019-05-03 | — | — | CN | disclosed |