Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | MET | P08581 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | NSD2 | O96028 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | WHR1 | P49842 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7267812 | 0.89 | PIK3CA (0.47) | SMN1; SMN2CYP1A2TSHRCYP3A4KDM4E | |
| SCHEMBL5259886 | 0.79 | HPGD (0.40) | SMN1; SMN2CYP1A2CYP3A4KDM4EALDH1A1 | |
| SCHEMBL5258158 | 0.78 | GAA (0.40) | SMN1; SMN2CYP1A2CYP3A4KDM4EALDH1A1 | |
| SCHEMBL7262625 | 0.74 | KDM4E (0.60) | SMN1; SMN2CYP1A2TSHRCYP3A4KDM4E | |
| SCHEMBL7262055 | 0.73 | TGFBR1 (0.43) | SMN1; SMN2TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL7268690 | 0.72 | PDE1B (0.57) | SMN1; SMN2TSHRCYP3A4KDM4EALDH1A1 | |
| SCHEMBL7261372 | 0.71 | MAPT (0.46) | SMN1; SMN2TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL7261507 | 0.70 | ALDH1A1 (0.52) | SMN1; SMN2CYP1A2TSHRCYP3A4KDM4E | |
| SCHEMBL7261986 | 0.70 | NPSR1 (0.47) | SMN1; SMN2CYP1A2TSHRKDM4EALDH1A1 | |
| SCHEMBL7267798 | 0.70 | HTR3E (0.45) | SMN1; SMN2CYP1A2TSHRCYP3A4KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-6613772-B1 | Drugs such as 2-(p-chlorophenyl-4-(4-hydroxybutyl)amino-6,7,8 -trimethoxyquinazoline used for activation of guanylate cyclase and modulation of cyclic guanosine monophosphate | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2003-09-02 | — | — | US | disclosed |