Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.36 |
| ▸ | PTPRC | P08575 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | TLR4 | O00206 | 1/20 | 0.35 |
| ▸ | TLR3 | O15455 | 1/20 | 0.35 |
| ▸ | TLR5 | O60602 | 1/20 | 0.35 |
| ▸ | TLR2 | O60603 | 1/20 | 0.35 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.35 |
| ▸ | CAMK2G | Q13555 | 1/20 | 0.35 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.35 |
| ▸ | CAMK1 | Q14012 | 1/20 | 0.35 |
| ▸ | CAMK4 | Q16566 | 1/20 | 0.35 |
| ▸ | PNCK | Q6P2M8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3745485 | 0.88 | BRD4 (0.46) | TLR4TLR3TLR5TLR2CAMK2B | |
| SCHEMBL3729445 | 0.87 | HSP90AA1 (0.41) | DHFRALDH1A1KDM4ETLR8ADORA2A | |
| SCHEMBL4377822 | 0.84 | MAP4K1 (0.38) | DHFRALDH1A1SCN9A | |
| SCHEMBL4376393 | 0.84 | HSP90AA1 (0.35) | DHFRALDH1A1 | |
| SCHEMBL4384579 | 0.81 | PTPN1 (0.37) | TLR8GRM5SCN9A | |
| SCHEMBL3734163 | 0.81 | PTPN1 (0.37) | KDM4ETSHRTLR8ADORA2AHSD17B10 | |
| SCHEMBL3739137 | 0.80 | HSD17B10 (0.38) | ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL3727477 | 0.80 | PTPN1 (0.38) | ALDH1A1TLR8ADORA2AADORA1 | |
| SCHEMBL3734730 | 0.77 | PTPN1 (0.41) | TLR8SCN9A | |
| SCHEMBL3737667 | 0.76 | ASIC3 (0.40) | ALDH1A1KDM4EPKMTLR8ADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1910359-B1 | PYRIDO [2 , 3-D]PYRIMIDINE-2 , 4-DIAMINE COMPOUNDS AS PTPlB INHIBITORS | HOFFMANN LA ROCHE (CH) | 2009-11-18 | — | — | EP | claimed |