Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29613223 | 0.84 | CYP1A2 (0.60) | CYP1A2MAPTKMT2ACYP2C19HIF1A | |
| SCHEMBL11715049 | 0.84 | CYP1A2 (0.54) | CYP1A2MAPTKMT2ACYP2C19HIF1A | |
| SCHEMBL305060 | 0.84 | CYP1A2 (0.60) | CYP1A2MAPTKMT2ACYP2C19HIF1A | |
| SCHEMBL16753453 | 0.84 | CYP1A2 (0.60) | CYP1A2MAPTKMT2ACYP2C19HIF1A | |
| SCHEMBL1817185 | 0.80 | MAPT (0.63) | CYP1A2MAPTKMT2ACYP2C19HIF1A | |
| SCHEMBL5552907 | 0.80 | CYP1A2 (0.50) | CYP1A2MAPTKMT2ACYP2C19HIF1A | |
| SCHEMBL8860523 | 0.79 | MAPT (0.50) | CYP1A2MAPTKMT2ACYP2C19HIF1A | |
| SCHEMBL3674752 | 0.79 | HDAC3 (0.57) | CYP1A2MAPTKMT2ACYP2C19HIF1A | |
| SCHEMBL5552910 | 0.79 | TSHR (0.46) | CYP1A2MAPTKMT2ACYP2C19HIF1A | |
| SCHEMBL343135 | 0.79 | MAPT (0.61) | CYP1A2MAPTKMT2ACYP2C19HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003035636-A2 | PROCESS FOR THE PREPARATION OF 3 - ISOCHROMANONE | SYNGENTA LIMITED (GB) | 2003-05-01 | — | — | WO | disclosed |
| EP-0532528-A1 | DERIVATIVES OF HYDROXY AND ALKOXY PYRIDINES | PFIZER INC. (US) | 1993-03-24 | — | — | EP | disclosed |
| WO-1991018881-A1 | DERIVATIVES OF HYDROXY AND ALKOXY PYRIDINES | PFIZER INC. (US) | 1991-12-12 | — | — | WO | disclosed |