Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 4/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.33 |
| ▸ | MTR | Q99707 | 2/20 | 0.32 |
| ▸ | LIPC | P11150 | 1/20 | 0.31 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL8997437 | 0.92 | DHFR (0.44) | DHFRNOS1SIRT2SIRT1PTGS1 | |
| SCHEMBL8569916 | 0.84 | MTR (0.41) | DHFRSIRT2SIRT1MTR | |
| SCHEMBL8997208 | 0.79 | DHFR (0.38) | DHFRNOS1SIRT2SIRT1PTGS1 | |
| SCHEMBL8562117 | 0.78 | MTR (0.44) | DHFRSIRT2SIRT1MTR | |
| SCHEMBL9439499 | 0.75 | DHFR (0.46) | DHFRNOS1SIRT2SIRT1 | |
| SCHEMBL8997222 | 0.75 | DHFR (0.36) | DHFRNOS1SIRT2SIRT1 | |
| SCHEMBL9446094 | 0.74 | — | — | |
| SCHEMBL8997209 | 0.72 | CYP4A11 (0.43) | DHFRNOS1 | |
| SCHEMBL9446064 | 0.69 | MTR (0.36) | MTR | |
| SCHEMBL9446114 | 0.69 | DHFR (0.46) | DHFR |
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 |
|---|---|---|---|---|---|---|---|
| JP-4235986-A | — | — | None | — | — | JP | disclosed |
| JP-H04235986-A | PYRIDOPYRIMIDINE DERIVATIVE, PRODUCTION AND USE THEREOF | TAKEDA CHEM IND LTD | 1992-08-25 | — | — | JP | disclosed |