Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1421745 | 0.83 | APP (0.49) | MAPTKMT2AMEN1CYP2C9CES2 | |
| SCHEMBL1626657 | 0.80 | CNR2 (0.48) | LMNAMAPTKMT2AMEN1CYP1A2 | |
| Fluorobenzene SCHEMBL28152955 | 0.78 | ALDH1A1 (0.56) | LMNAALDH1A1HSD17B10MAPTKMT2A | |
| SCHEMBL7216769 | 0.76 | CA12 (0.58) | LMNAALDH1A1MAPTKMT2AMEN1 | |
| SCHEMBL1626934 | 0.75 | MAPT (0.42) | LMNAALDH1A1MAPTKMT2AMEN1 | |
| SCHEMBL6977075 | 0.73 | CHRM2 (0.48) | LMNAMAPTKMT2AMEN1CYP1A2 | |
| Ethyl Acetate SCHEMBL27956511 | 0.73 | HPGD (0.52) | LMNAALDH1A1HSD17B10MAPTKMT2A | |
| SCHEMBL3497043 | 0.73 | MAPT (0.52) | ALDH1A1MAPTKMT2ACYP2C9CYP2C19 | |
| SCHEMBL19183403 | 0.72 | MAPT (0.49) | LMNAMAPTKMT2AMEN1CYP1A2 | |
| SCHEMBL9768982 | 0.72 | KMT2A (0.48) | MAPTKMT2AMEN1CES2CES1 |
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-105037059-A | Preparation method of alpha-(4-substituted phenyl)isobutyric acid | UNIV QINGDAO SCIENCE & TECHNOLOGY | 2015-11-11 | — | — | CN | disclosed |