Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | PAM | P19021 | 2/20 | 0.44 |
| ▸ | GRIK1 | P39086 | 3/20 | 0.44 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | TNKS | O95271 | 1/20 | 0.44 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27339917 | 0.82 | CNR2 (0.43) | CYP1A2CNR2ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL11069954 | 0.81 | CYP1A2 (0.53) | CYP1A2CNR2PAMGRIK1GRIK2 | |
| SCHEMBL5480228 | 0.81 | CYP1A2 (0.53) | CYP1A2CNR2PAMGRIK1GRIK2 | |
| SCHEMBL9632505 | 0.80 | PPARG (0.53) | CYP1A2CNR2HDAC3HDAC4HDAC1 | |
| SCHEMBL29209801 | 0.80 | CYP1A2 (0.51) | CYP1A2CNR2PAMGRIK1GRIK2 | |
| SCHEMBL6406292 | 0.80 | ALDH1A1 (0.51) | CYP1A2CNR2PAMALDH1A1HDAC3 | |
| SCHEMBL9146868 | 0.77 | CYP1A2 (0.49) | CYP1A2CNR2PAMALDH1A1HDAC3 | |
| SCHEMBL11580231 | 0.77 | PPARA (0.49) | CYP1A2CNR2PAMALDH1A1HDAC3 | |
| SCHEMBL7941808 | 0.76 | CYP1A2 (0.47) | CYP1A2CNR2PAMGRIK1GRIK2 | |
| SCHEMBL1078140 | 0.75 | CYP1A2 (0.46) | CYP1A2CNR2PAMALDH1A1HDAC3 |
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-1060096-A | FIBRINOGEN RECEPTOR ANLAGONISTS | MERCK & CO INC (US) | 1992-04-08 | — | — | CN | disclosed |