Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 2/20 | 0.38 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CTSA | P10619 | 1/20 | 0.37 |
| ▸ | MIF | P14174 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2364654 | 0.83 | CYP2C19 (0.40) | CYP2C19HIF1ACYP1A2MAPTALDH1A1 | |
| SCHEMBL28754961 | 0.80 | CYP2C19 (0.51) | CYP2C19HIF1AKCNN4L3MBTL1KMT2A | |
| SCHEMBL1144525 | 0.77 | CYP2C19 (0.56) | CYP2C19HIF1ACYP1A2MAPTALDH1A1 | |
| SCHEMBL1144509 | 0.75 | CYP2C19 (0.49) | CYP2C19HIF1ACYP1A2MAPTALDH1A1 | |
| SCHEMBL1144390 | 0.75 | CYP2C19 (0.49) | CYP2C19HIF1ACYP1A2MAPTALDH1A1 | |
| SCHEMBL31358110 | 0.71 | KCNN4 (0.47) | CYP2C19HIF1ACYP1A2MAPTALDH1A1 | |
| SCHEMBL8226385 | 0.71 | KCNN4 (0.50) | CYP2C19HIF1ACYP1A2MAPTALDH1A1 | |
| SCHEMBL3322720 | 0.71 | MAPT (0.50) | CYP2C19HIF1ACYP1A2MAPTALDH1A1 | |
| SCHEMBL6548609 | 0.71 | HIF1A (0.57) | CYP2C19HIF1ACYP1A2MAPTALDH1A1 | |
| SCHEMBL13881112 | 0.70 | KCNN4 (0.45) | CYP2C19HIF1ACYP1A2MAPTALDH1A1 |
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-1928102-B | Resolution method of beta-amino acid | ASTATECH CHENGDU PHARMACEUTIACL CO LTD | 2011-08-10 | — | — | CN | disclosed |
| CN-1928102-A | Resolution method of beta-amino acid | ASTATECH CHENGDU PHARMACEUTIAC (CN) | 2007-03-14 | — | — | CN | disclosed |