Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.38 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 5/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | DHODH | Q02127 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13537965 | 0.86 | NPSR1 (0.41) | NPSR1GLO1ALDH1A1TSHRCYP2D6 | |
| SCHEMBL14205772 | 0.80 | NPSR1 (0.36) | NPSR1GLO1ALDH1A1TSHRCYP2D6 | |
| SCHEMBL13537969 | 0.76 | NPSR1 (0.40) | NPSR1GLO1ALDH1A1TSHRCYP2D6 | |
| SCHEMBL1543791 | 0.73 | NPSR1 (0.58) | NPSR1GLO1ALDH1A1TSHRCYP2D6 | |
| SCHEMBL8156973 | 0.72 | ALDH1A1 (0.38) | NPSR1GLO1ALDH1A1TSHR | |
| SCHEMBL19453304 | 0.71 | GLO1 (0.34) | NPSR1GLO1ALDH1A1TSHRMAPT | |
| SCHEMBL8692317 | 0.68 | NPSR1 (0.44) | NPSR1GLO1ALDH1A1TSHRCYP2D6 | |
| SCHEMBL7850899 | 0.68 | NPSR1 (0.44) | NPSR1GLO1ALDH1A1TSHRCYP2D6 | |
| SCHEMBL14224608 | 0.68 | GLO1 (0.69) | NPSR1GLO1ALDH1A1TSHRCYP2D6 | |
| SCHEMBL10986214 | 0.68 | NPSR1 (0.52) | NPSR1GLO1ALDH1A1TSHRCYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012018540-A1 | 2-SUBSTITUTED-8-ALKYL-7-OXO-7,8-DIHYDROPYRIDO[2,3-D] PYRIMIDINE-6-CARBONITRILES AND USES THEREOF | TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2012-02-09 | — | — | WO | disclosed |
| WO-2008055842-A1 | SUBSTITUTED 6-PHENYL-PYRIDO [2,3-D] PYRIMIDIN-7-ONE DERIVATIVES AS KINASE INHIBITORS AND METHODS FOR USING THE SAME | F. HOFFMANN-LA ROCHE AG (CH) | 2008-05-15 | — | — | WO | disclosed |