Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 2/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | USP7 | Q93009 | 4/20 | 0.31 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.30 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5798382 | 0.87 | PIK3CG (0.41) | DHFRPIK3CGLIMK1 | |
| SCHEMBL5796211 | 0.84 | DHFR (0.35) | DHFR | |
| SCHEMBL5798453 | 0.77 | MAP4K4 (0.40) | LIMK1USP7 | |
| SCHEMBL5798083 | 0.77 | DHFR (0.36) | DHFRPIK3CGLIMK1HRH4 | |
| SCHEMBL5798079 | 0.77 | CDK2 (0.39) | DHFR | |
| SCHEMBL5799326 | 0.75 | FFAR1 (0.43) | DHFR | |
| SCHEMBL5798735 | 0.74 | DHFR (0.36) | DHFR | |
| SCHEMBL5773193 | 0.74 | DHFR (0.34) | DHFR | |
| SCHEMBL4688376 | 0.74 | DHFR (0.50) | DHFRUSP7 | |
| SCHEMBL5796107 | 0.73 | DHFR (0.36) | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1628979-A1 | DIAMINOPYRROLOQUINAZOLINES COMPOUNDS AS PROTEIN TYROSINE PHOSPHATASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-03-01 | — | — | EP | claimed |
| WO-2004101568-A1 | DIAMINOPYRROLOQUINAZOLINES COMPOUNDS AS PROTEIN TYROSINE PHOSPHATASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2004-11-25 | — | — | WO | claimed |
| EP-1628979-A1 | DIAMINOPYRROLOQUINAZOLINES COMPOUNDS AS PROTEIN TYROSINE PHOSPHATASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-03-01 | — | — | EP | disclosed |
| WO-2004101568-A1 | DIAMINOPYRROLOQUINAZOLINES COMPOUNDS AS PROTEIN TYROSINE PHOSPHATASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2004-11-25 | — | — | WO | disclosed |