Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | HPGD | P15428 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.60 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12470503 | 0.86 | ALDH1A1 (0.66) | ALDH1A1KMT2AHPGDMEN1CYP2C9 | |
| SCHEMBL29434803 | 0.86 | ALDH1A1 (0.66) | ALDH1A1KMT2AHPGDMEN1CYP2C9 | |
| Ammonia Solution, Strong SCHEMBL29194251 | 0.85 | ALDH1A1 (0.64) | ALDH1A1KMT2AHPGDMEN1CYP2C9 | |
| Acrylic Acid SCHEMBL1505000 | 0.84 | ALDH1A1 (0.57) | ALDH1A1KMT2AHPGDMEN1CYP2C9 | |
| Propanol SCHEMBL28052966 | 0.81 | ALDH1A1 (0.62) | ALDH1A1KMT2AHPGDMEN1CYP2C9 | |
| SCHEMBL10144027 | 0.79 | ALDH1A1 (0.74) | ALDH1A1KMT2AHPGDMEN1CYP2C9 | |
| SCHEMBL29020526 | 0.78 | MDM4 (0.67) | ALDH1A1KMT2AHPGDMEN1CYP2C9 | |
| SCHEMBL6067716 | 0.78 | HDAC1 (0.66) | KMT2AHPGDMEN1CYP2C9ABCG2 | |
| SCHEMBL9695830 | 0.77 | ALDH1A1 (0.64) | ALDH1A1KMT2AHPGDCYP2C9KDM4E | |
| SCHEMBL28442225 | 0.76 | HDAC1 (0.61) | ALDH1A1KMT2AHPGDMEN1CYP2C9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105330569-A | Preparation method of (R)-2-(N-tertbutyloxycarbonylamino)biphenylpropanol | TONGJING OPTOELECTRONICS TECHNOLOGY CO LTD | 2016-02-17 | — | — | CN | disclosed |