Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | SNCA | P37840 | 2/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | GSK3B | P49841 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7530158 | 0.87 | CYP1A2 (0.40) | CYP1A2SNCAPDK1ALDH1A1TSHR | |
| SCHEMBL16961402 | 0.82 | PDK1 (0.42) | CYP1A2SNCAPDK1ALDH1A1TSHR | |
| SCHEMBL16961286 | 0.81 | PDK1 (0.51) | CYP1A2SNCAPDK1ALDH1A1TSHR | |
| SCHEMBL7058516 | 0.80 | S100A4 (0.45) | CYP1A2SNCAPDK1ALDH1A1TSHR | |
| SCHEMBL28531178 | 0.80 | CYP1A2 (0.44) | CYP1A2SNCAPDK1ALDH1A1TSHR | |
| SCHEMBL7534585 | 0.80 | CYP1A2 (0.40) | CYP1A2SNCAPDK1ALDH1A1TSHR | |
| SCHEMBL10884758 | 0.80 | CYP1A2 (0.60) | CYP1A2ALDH1A1TSHRMAPTMEN1 | |
| SCHEMBL28064303 | 0.79 | CYP1A2 (0.37) | CYP1A2SNCAPDK1ALDH1A1TSHR | |
| SCHEMBL3401772 | 0.79 | TDP1 (0.52) | CYP1A2SNCAPDK1ALDH1A1MAPT | |
| SCHEMBL5740032 | 0.79 | MAPK1 (0.52) | CYP1A2ALDH1A1TSHRMAPTMEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105579457-A | Substituted N-biphenyl-3-acetylamino-benzamides and N- [3- (acetylamino) phenyl ] -biphenyl-carboxamides and their use as WNT signaling pathway inhibitors | Bayer Pharma AG | 2016-05-11 | — | — | CN | disclosed |
| CN-104817519-A | CA-4 derivatives as well as preparation method and medical application of CA-4 derivatives | UNIV CHINA PHARMA | 2015-08-05 | — | — | CN | disclosed |
| CN-104271552-A | Substituted heterocyclic acetamides as KAPPA opioid receptor (KOR) agonists | REDDYS LAB LTD DR | 2015-01-07 | — | — | CN | disclosed |
| CN-102964294-A | Pyridyl inhibitors of hedgehog signalling | GENENTECH INC | 2013-03-13 | — | — | CN | disclosed |